N-methyl-4-[[(E)-3-(4-methylphenyl)prop-2-enoyl]carbamothioylamino]-N-phenyl-benzamide

Systemtic Name: N-methyl-4-[[(E)-3-(4-methylphenyl)prop-2-enoyl]carbamothioylamino]-N-phenyl-benzamide Openeye Name: N-methyl-N-phenyl-4-[[(E)-3-(p-tolyl)prop-2-enoyl]carbamothioylamino]benzamide CAS Name: N-methyl-4-[[[[(E)-3-(4-methylphenyl)-1-oxoprop-2-enyl]amino]-sulfanylidenemethyl]amino]-N-phenylbenzamide IUPAC Name: N-methyl-4-[[(E)-3-(4-methylphenyl)prop-2-enoyl]carbamothioylamino]-N-phenylbenzamide Traditional Name: N-methyl-N-phenyl-4-[[(E)-3-(p-tolyl)acryloyl]thiocarbamoylamino]benzamide Formula: C25H23N3O2S MolecularWeight: 429.53402

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H23N3O2S/c1-18-8-10-19(11-9-18)12-17-23(29)27-25(31)26-21-15-13-20(14-16-21)24(30)28(2)22-6-4-3-5-7-22/h3-17H,1-2H3,(H2,26,27,29,31)/b17-12+