N-[[3-[(4-tert-butylphenyl)carbonylamino]phenyl]carbamothioyl]-4-phenyl-benzamide

Systemtic Name: N-[[3-[(4-tert-butylphenyl)carbonylamino]phenyl]carbamothioyl]-4-phenyl-benzamide Openeye Name: N-[[3-[(4-tert-butylbenzoyl)amino]phenyl]carbamothioyl]-4-phenyl-benzamide CAS Name: N-[[3-[[(4-tert-butylphenyl)-oxomethyl]amino]anilino]-sulfanylidenemethyl]-4-phenylbenzamide IUPAC Name: N-[[3-[(4-tert-butylbenzoyl)amino]phenyl]carbamothioyl]-4-phenylbenzamide Traditional Name: N-[[3-[(4-tert-butylbenzoyl)amino]phenyl]thiocarbamoyl]-4-phenyl-benzamide Formula: C31H29N3O2S MolecularWeight: 507.64586

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C31H29N3O2S/c1-31(2,3)25-18-16-24(17-19-25)28(35)32-26-10-7-11-27(20-26)33-30(37)34-29(36)23-14-12-22(13-15-23)21-8-5-4-6-9-21/h4-20H,1-3H3,(H,32,35)(H2,33,34,36,37)