propyl 2-[(4-aminocarbonyl-1H-benzimidazol-2-yl)sulfanyl]-2-(4-methoxyphenyl)ethanoate

Systemtic Name: propyl 2-[(4-aminocarbonyl-1H-benzimidazol-2-yl)sulfanyl]-2-(4-methoxyphenyl)ethanoate Openeye Name: propyl 2-[(4-carbamoyl-1H-benzimidazol-2-yl)sulfanyl]-2-(4-methoxyphenyl)acetate CAS Name: 2-[(4-carbamoyl-1H-benzimidazol-2-yl)thio]-2-(4-methoxyphenyl)acetic acid propyl ester IUPAC Name: propyl 2-[(4-carbamoyl-1H-benzimidazol-2-yl)sulfanyl]-2-(4-methoxyphenyl)acetate Traditional Name: 2-[(4-carbamoyl-1H-benzimidazol-2-yl)thio]-2-(4-methoxyphenyl)acetic acid propyl ester Formula: C20H21N3O4S MolecularWeight: 399.46344

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C(C1=CC=C(C=C1)OC)SC2=NC3=C(C=CC=C3N2)C(=O)N

Isomeric SMILES

CCCOC(=O)C(C1=CC=C(C=C1)OC)SC2=NC3=C(C=CC=C3N2)C(=O)N

InChI

InChI=1S/C20H21N3O4S/c1-3-11-27-19(25)17(12-7-9-13(26-2)10-8-12)28-20-22-15-6-4-5-14(18(21)24)16(15)23-20/h4-10,17H,3,11H2,1-2H3,(H2,21,24)(H,22,23)