propyl 3-[2-(1,4-diphenylimidazol-2-yl)sulfanylethanoylamino]benzoate

Systemtic Name: propyl 3-[2-(1,4-diphenylimidazol-2-yl)sulfanylethanoylamino]benzoate Openeye Name: propyl 3-[[2-(1,4-diphenylimidazol-2-yl)sulfanylacetyl]amino]benzoate CAS Name: 3-[[2-[(1,4-diphenyl-2-imidazolyl)thio]-1-oxoethyl]amino]benzoic acid propyl ester IUPAC Name: propyl 3-[[2-(1,4-diphenylimidazol-2-yl)sulfanylacetyl]amino]benzoate Traditional Name: 3-[[2-[(1,4-diphenylimidazol-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(=CN2C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCCOC(=O)C1=CC(=CC=C1)NC(=O)CSC2=NC(=CN2C3=CC=CC=C3)C4=CC=CC=C4

InChI

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