ethyl 4-azanyl-3-(1H-benzimidazol-2-ylsulfanylmethyl)benzoate

Systemtic Name: ethyl 4-azanyl-3-(1H-benzimidazol-2-ylsulfanylmethyl)benzoate Openeye Name: ethyl 4-amino-3-(1H-benzimidazol-2-ylsulfanylmethyl)benzoate CAS Name: 4-amino-3-[(1H-benzimidazol-2-ylthio)methyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-amino-3-(1H-benzimidazol-2-ylsulfanylmethyl)benzoate Traditional Name: 4-amino-3-[(1H-benzimidazol-2-ylthio)methyl]benzoic acid ethyl ester Formula: C17H17N3O2S MolecularWeight: 327.40078

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1)N)CSC2=NC3=CC=CC=C3N2

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1)N)CSC2=NC3=CC=CC=C3N2

InChI

InChI=1S/C17H17N3O2S/c1-2-22-16(21)11-7-8-13(18)12(9-11)10-23-17-19-14-5-3-4-6-15(14)20-17/h3-9H,2,10,18H2,1H3,(H,19,20)