2-[[(E)-3-(2-chlorophenyl)prop-2-enoyl]carbamothioylamino]-N-prop-2-enyl-benzamide

Systemtic Name: 2-[[(E)-3-(2-chlorophenyl)prop-2-enoyl]carbamothioylamino]-N-prop-2-enyl-benzamide Openeye Name: N-allyl-2-[[(E)-3-(2-chlorophenyl)prop-2-enoyl]carbamothioylamino]benzamide CAS Name: 2-[[[[(E)-3-(2-chlorophenyl)-1-oxoprop-2-enyl]amino]-sulfanylidenemethyl]amino]-N-prop-2-enylbenzamide IUPAC Name: 2-[[(E)-3-(2-chlorophenyl)prop-2-enoyl]carbamothioylamino]-N-prop-2-enylbenzamide Traditional Name: N-allyl-2-[[(E)-3-(2-chlorophenyl)acryloyl]thiocarbamoylamino]benzamide Formula: C20H18ClN3O2S MolecularWeight: 399.89382

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)C1=CC=CC=C1NC(=S)NC(=O)C=CC2=CC=CC=C2Cl

Isomeric SMILES

C=CCNC(=O)C1=CC=CC=C1NC(=S)NC(=O)/C=C/C2=CC=CC=C2Cl

InChI

InChI=1S/C20H18ClN3O2S/c1-2-13-22-19(26)15-8-4-6-10-17(15)23-20(27)24-18(25)12-11-14-7-3-5-9-16(14)21/h2-12H,1,13H2,(H,22,26)(H2,23,24,25,27)/b12-11+