2-[[(E)-3-(4-chlorophenyl)prop-2-enoyl]carbamothioylamino]benzoate

Systemtic Name: 2-[[(E)-3-(4-chlorophenyl)prop-2-enoyl]carbamothioylamino]benzoate Openeye Name: 2-[[(E)-3-(4-chlorophenyl)prop-2-enoyl]carbamothioylamino]benzoate CAS Name: 2-[[[[(E)-3-(4-chlorophenyl)-1-oxoprop-2-enyl]amino]-sulfanylidenemethyl]amino]benzoate IUPAC Name: 2-[[(E)-3-(4-chlorophenyl)prop-2-enoyl]carbamothioylamino]benzoate Traditional Name: 2-[[(E)-3-(4-chlorophenyl)acryloyl]thiocarbamoylamino]benzoate Formula: C17H12ClN2O3S- MolecularWeight: 359.80678

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)[O-])NC(=S)NC(=O)C=CC2=CC=C(C=C2)Cl

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)[O-])NC(=S)NC(=O)/C=C/C2=CC=C(C=C2)Cl

InChI

InChI=1S/C17H13ClN2O3S/c18-12-8-5-11(6-9-12)7-10-15(21)20-17(24)19-14-4-2-1-3-13(14)16(22)23/h1-10H,(H,22,23)(H2,19,20,21,24)/p-1/b10-7+