N-[4-(2,2-diphenylethanoylcarbamothioylamino)phenyl]-3-methyl-benzamide

Systemtic Name: N-[4-(2,2-diphenylethanoylcarbamothioylamino)phenyl]-3-methyl-benzamide Openeye Name: N-[4-[(2,2-diphenylacetyl)carbamothioylamino]phenyl]-3-methyl-benzamide CAS Name: 3-methyl-N-[4-[[[(1-oxo-2,2-diphenylethyl)amino]-sulfanylidenemethyl]amino]phenyl]benzamide IUPAC Name: N-[4-[(2,2-diphenylacetyl)carbamothioylamino]phenyl]-3-methylbenzamide Traditional Name: N-[4-[(2,2-diphenylacetyl)thiocarbamoylamino]phenyl]-3-methyl-benzamide Formula: C29H25N3O2S MolecularWeight: 479.5927

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NC2=CC=C(C=C2)NC(=S)NC(=O)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NC2=CC=C(C=C2)NC(=S)NC(=O)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C29H25N3O2S/c1-20-9-8-14-23(19-20)27(33)30-24-15-17-25(18-16-24)31-29(35)32-28(34)26(21-10-4-2-5-11-21)22-12-6-3-7-13-22/h2-19,26H,1H3,(H,30,33)(H2,31,32,34,35)