propyl 4-[2-[(6-methoxy-1H-benzimidazol-2-yl)sulfanyl]ethanoylamino]benzoate

Systemtic Name: propyl 4-[2-[(6-methoxy-1H-benzimidazol-2-yl)sulfanyl]ethanoylamino]benzoate Openeye Name: propyl 4-[[2-[(6-methoxy-1H-benzimidazol-2-yl)sulfanyl]acetyl]amino]benzoate CAS Name: 4-[[2-[(6-methoxy-1H-benzimidazol-2-yl)thio]-1-oxoethyl]amino]benzoic acid propyl ester IUPAC Name: propyl 4-[[2-[(6-methoxy-1H-benzimidazol-2-yl)sulfanyl]acetyl]amino]benzoate Traditional Name: 4-[[2-[(6-methoxy-1H-benzimidazol-2-yl)thio]acetyl]amino]benzoic acid propyl ester Formula: C20H21N3O4S MolecularWeight: 399.46344

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC3=C(N2)C=C(C=C3)OC

Isomeric SMILES

CCCOC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC3=C(N2)C=C(C=C3)OC

InChI

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