Registration Dossier

Reference substances

Reference substances

IUPAC name:
5-methoxy-1,3-dihydro-2H-benzimidazole-2-thione

Inventory

EC number:
253-326-2
EC name:
1,3-dihydro-5-methoxy-2H-benzimidazole-2-thione
CAS number:
37052-78-1
CAS number:
37052-78-1
Synonyms
Names:
1,3-dihydro-5-methoxy-2h-benzimidazole-2-thione
5-methoxy-1H-benzo[d]imidazole-2-thiol
Identifier:
IUPAC name
1,3-dihydro-5-methoxy-2H-benzimidazole-2-thione
Identifier:
IUPAC name
5-Methoxy-1H-benzimidazole-2-thiol
Identifier:
IUPAC name
5-methoxy-1,3-dihydrobenzimidazole-2-thione
Identifier:
PubChem
5-methoxy-1H-benzimidazole-2-thiol
Identifier:
PubChem
5-Methoxy-2-benzimidazolethiol
Identifier:
PubChem
5-Methoxy-2-mercaptobenzimidazole
Identifier:
PubChem
5-methoxy-1H-benzo[d]imidazole-2-thiol
Identifier:
other: InChl
1S/C8H8N2OS/c1-11-5-2-3-6-7(4-5)10-8(12)9-6/h2-4H,1H3,(H2,9,10,12)
Identifier:
other: Molecular formula
C8 H8 N2 O S
Identifier:
other: SMILES notation
COC1=CC2=C(C=C1)NC(=S)N2
Identifier:
other: SMILES notation
COC1=CC=C2C(N=C(S)N2)=C1
Identifier:
other: SMILES notation
COc1ccc2c(c1)[nH]c(=S)[nH]2
Identifier:
other: InChl
InChI=1/C8H8N2OS/c1-11-5-2-3-6-7(4-5)10-8(12)9-6/h2-4H,1H3,(H2,9,10,12)/i1-12,2-12,3-12,4-12,5-12,6-12,7-12,8-12,9-14,10-14,11-16,12-32
Identifier:
other: InChl
InChI=1S/C8H8N2OS/c1-11-5-2-3-6-7(4-5)10-8(12)9-6/h2-4H,1H3,(H2,9,10,12)
5-methoxy-1,3-dihydro-2H-benzimidazole-2-thione

Molecular and structural information

Molecular formula:
C8H8N2OS
Molecular weight:
180.227
SMILES notation:
COc1ccc2NC(=S)Nc2c1
InChl:
InChI=1/C8H8N2OS/c1-11-5-2-3-6-7(4-5)10-8(12)9-6/h2-4H,1H3,(H2,9,10,12)
Structural formula:
Chemical structure

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