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

Systemtic Name: methyl 4-[2-[(4,5-diphenyl-1H-imidazol-2-yl)sulfanyl]ethanoylamino]benzoate Openeye Name: methyl 4-[[2-[(4,5-diphenyl-1H-imidazol-2-yl)sulfanyl]acetyl]amino]benzoate CAS Name: 4-[[2-[(4,5-diphenyl-1H-imidazol-2-yl)thio]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-[(4,5-diphenyl-1H-imidazol-2-yl)sulfanyl]acetyl]amino]benzoate Traditional Name: 4-[[2-[(4,5-diphenyl-1H-imidazol-2-yl)thio]acetyl]amino]benzoic acid methyl ester Formula: C25H21N3O3S MolecularWeight: 443.51754

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H21N3O3S/c1-31-24(30)19-12-14-20(15-13-19)26-21(29)16-32-25-27-22(17-8-4-2-5-9-17)23(28-25)18-10-6-3-7-11-18/h2-15H,16H2,1H3,(H,26,29)(H,27,28)