3-[(3-ethanoylphenyl)carbamothioylamino]-N-(phenylmethyl)benzamide

Systemtic Name: 3-[(3-ethanoylphenyl)carbamothioylamino]-N-(phenylmethyl)benzamide Openeye Name: 3-[(3-acetylphenyl)carbamothioylamino]-N-benzyl-benzamide CAS Name: 3-[[(3-acetylanilino)-sulfanylidenemethyl]amino]-N-(phenylmethyl)benzamide IUPAC Name: 3-[(3-acetylphenyl)carbamothioylamino]-N-benzylbenzamide Traditional Name: 3-[(3-acetylphenyl)thiocarbamoylamino]-N-benzyl-benzamide Formula: C23H21N3O2S MolecularWeight: 403.49674

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)NC(=S)NC2=CC=CC(=C2)C(=O)NCC3=CC=CC=C3

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)NC(=S)NC2=CC=CC(=C2)C(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C23H21N3O2S/c1-16(27)18-9-5-11-20(13-18)25-23(29)26-21-12-6-10-19(14-21)22(28)24-15-17-7-3-2-4-8-17/h2-14H,15H2,1H3,(H,24,28)(H2,25,26,29)