ethyl 4-[2-(1H-benzimidazol-2-ylsulfanyl)propanoylamino]benzoate

Systemtic Name: ethyl 4-[2-(1H-benzimidazol-2-ylsulfanyl)propanoylamino]benzoate Openeye Name: ethyl 4-[2-(1H-benzimidazol-2-ylsulfanyl)propanoylamino]benzoate CAS Name: 4-[[2-(1H-benzimidazol-2-ylthio)-1-oxopropyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[2-(1H-benzimidazol-2-ylsulfanyl)propanoylamino]benzoate Traditional Name: 4-[2-(1H-benzimidazol-2-ylthio)propanoylamino]benzoic acid ethyl ester Formula: C19H19N3O3S MolecularWeight: 369.43746

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)C(C)SC2=NC3=CC=CC=C3N2

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)C(C)SC2=NC3=CC=CC=C3N2

InChI

InChI=1S/C19H19N3O3S/c1-3-25-18(24)13-8-10-14(11-9-13)20-17(23)12(2)26-19-21-15-6-4-5-7-16(15)22-19/h4-12H,3H2,1-2H3,(H,20,23)(H,21,22)