propyl 3-[2-[(4,5-diphenyl-1H-imidazol-2-yl)sulfanyl]ethanoylamino]benzoate

Systemtic Name: propyl 3-[2-[(4,5-diphenyl-1H-imidazol-2-yl)sulfanyl]ethanoylamino]benzoate Openeye Name: propyl 3-[[2-[(4,5-diphenyl-1H-imidazol-2-yl)sulfanyl]acetyl]amino]benzoate CAS Name: 3-[[2-[(4,5-diphenyl-1H-imidazol-2-yl)thio]-1-oxoethyl]amino]benzoic acid propyl ester IUPAC Name: propyl 3-[[2-[(4,5-diphenyl-1H-imidazol-2-yl)sulfanyl]acetyl]amino]benzoate Traditional Name: 3-[[2-[(4,5-diphenyl-1H-imidazol-2-yl)thio]acetyl]amino]benzoic acid propyl ester Formula: C27H25N3O3S MolecularWeight: 471.5707

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC(=CC=C1)NC(=O)CSC2=NC(=C(N2)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCCOC(=O)C1=CC(=CC=C1)NC(=O)CSC2=NC(=C(N2)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H25N3O3S/c1-2-16-33-26(32)21-14-9-15-22(17-21)28-23(31)18-34-27-29-24(19-10-5-3-6-11-19)25(30-27)20-12-7-4-8-13-20/h3-15,17H,2,16,18H2,1H3,(H,28,31)(H,29,30)