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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C=CC(=O)NC(=S)NC2=CC=CC(=C2)C(=O)NC3=CC=CC(=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)/C=C/C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)NC3=CC=CC(=C3)C

InChI

InChI=1S/C25H23N3O2S/c1-17-9-11-19(12-10-17)13-14-23(29)28-25(31)27-22-8-4-6-20(16-22)24(30)26-21-7-3-5-18(2)15-21/h3-16H,1-2H3,(H,26,30)(H2,27,28,29,31)/b14-13+