methyl 2-[(4-aminocarbonyl-1H-benzimidazol-2-yl)sulfanyl]-2-(4-hydroxyphenyl)ethanoate

Systemtic Name: methyl 2-[(4-aminocarbonyl-1H-benzimidazol-2-yl)sulfanyl]-2-(4-hydroxyphenyl)ethanoate Openeye Name: methyl 2-[(4-carbamoyl-1H-benzimidazol-2-yl)sulfanyl]-2-(4-hydroxyphenyl)acetate CAS Name: 2-[(4-carbamoyl-1H-benzimidazol-2-yl)thio]-2-(4-hydroxyphenyl)acetic acid methyl ester IUPAC Name: methyl 2-[(4-carbamoyl-1H-benzimidazol-2-yl)sulfanyl]-2-(4-hydroxyphenyl)acetate Traditional Name: 2-[(4-carbamoyl-1H-benzimidazol-2-yl)thio]-2-(4-hydroxyphenyl)acetic acid methyl ester Formula: C17H15N3O4S MolecularWeight: 357.3837

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1=CC=C(C=C1)O)SC2=NC3=C(C=CC=C3N2)C(=O)N

Isomeric SMILES

COC(=O)C(C1=CC=C(C=C1)O)SC2=NC3=C(C=CC=C3N2)C(=O)N

InChI

InChI=1S/C17H15N3O4S/c1-24-16(23)14(9-5-7-10(21)8-6-9)25-17-19-12-4-2-3-11(15(18)22)13(12)20-17/h2-8,14,21H,1H3,(H2,18,22)(H,19,20)