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

Systemtic Name: 2-[[(E)-3-(4-methylphenyl)prop-2-enoyl]carbamothioylamino]-N-propyl-benzamide Openeye Name: N-propyl-2-[[(E)-3-(p-tolyl)prop-2-enoyl]carbamothioylamino]benzamide CAS Name: 2-[[[[(E)-3-(4-methylphenyl)-1-oxoprop-2-enyl]amino]-sulfanylidenemethyl]amino]-N-propylbenzamide IUPAC Name: 2-[[(E)-3-(4-methylphenyl)prop-2-enoyl]carbamothioylamino]-N-propylbenzamide Traditional Name: N-propyl-2-[[(E)-3-(p-tolyl)acryloyl]thiocarbamoylamino]benzamide Formula: C21H23N3O2S MolecularWeight: 381.49122

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1=CC=CC=C1NC(=S)NC(=O)C=CC2=CC=C(C=C2)C

Isomeric SMILES

CCCNC(=O)C1=CC=CC=C1NC(=S)NC(=O)/C=C/C2=CC=C(C=C2)C

InChI

InChI=1S/C21H23N3O2S/c1-3-14-22-20(26)17-6-4-5-7-18(17)23-21(27)24-19(25)13-12-16-10-8-15(2)9-11-16/h4-13H,3,14H2,1-2H3,(H,22,26)(H2,23,24,25,27)/b13-12+