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

Systemtic Name: N-cyclohexyl-4-[[(E)-3-(4-methylphenyl)prop-2-enoyl]carbamothioylamino]benzamide Openeye Name: N-cyclohexyl-4-[[(E)-3-(p-tolyl)prop-2-enoyl]carbamothioylamino]benzamide CAS Name: N-cyclohexyl-4-[[[[(E)-3-(4-methylphenyl)-1-oxoprop-2-enyl]amino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-cyclohexyl-4-[[(E)-3-(4-methylphenyl)prop-2-enoyl]carbamothioylamino]benzamide Traditional Name: N-cyclohexyl-4-[[(E)-3-(p-tolyl)acryloyl]thiocarbamoylamino]benzamide Formula: C24H27N3O2S MolecularWeight: 421.55508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C=CC(=O)NC(=S)NC2=CC=C(C=C2)C(=O)NC3CCCCC3

Isomeric SMILES

CC1=CC=C(C=C1)/C=C/C(=O)NC(=S)NC2=CC=C(C=C2)C(=O)NC3CCCCC3

InChI

InChI=1S/C24H27N3O2S/c1-17-7-9-18(10-8-17)11-16-22(28)27-24(30)26-21-14-12-19(13-15-21)23(29)25-20-5-3-2-4-6-20/h7-16,20H,2-6H2,1H3,(H,25,29)(H2,26,27,28,30)/b16-11+