N-(3,4-dimethylphenyl)-2-(2,2-diphenylethanoylcarbamothioylamino)benzamide

Systemtic Name: N-(3,4-dimethylphenyl)-2-(2,2-diphenylethanoylcarbamothioylamino)benzamide Openeye Name: N-(3,4-dimethylphenyl)-2-[(2,2-diphenylacetyl)carbamothioylamino]benzamide CAS Name: N-(3,4-dimethylphenyl)-2-[[[(1-oxo-2,2-diphenylethyl)amino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-(3,4-dimethylphenyl)-2-[(2,2-diphenylacetyl)carbamothioylamino]benzamide Traditional Name: N-(3,4-dimethylphenyl)-2-[(2,2-diphenylacetyl)thiocarbamoylamino]benzamide Formula: C30H27N3O2S MolecularWeight: 493.61928

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC=CC=C2NC(=S)NC(=O)C(C3=CC=CC=C3)C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC=CC=C2NC(=S)NC(=O)C(C3=CC=CC=C3)C4=CC=CC=C4)C

InChI

InChI=1S/C30H27N3O2S/c1-20-17-18-24(19-21(20)2)31-28(34)25-15-9-10-16-26(25)32-30(36)33-29(35)27(22-11-5-3-6-12-22)23-13-7-4-8-14-23/h3-19,27H,1-2H3,(H,31,34)(H2,32,33,35,36)