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

Systemtic Name: ethyl 2-[[(E)-3-(4-chlorophenyl)prop-2-enoyl]carbamothioylamino]ethanoate Openeye Name: ethyl 2-[[(E)-3-(4-chlorophenyl)prop-2-enoyl]carbamothioylamino]acetate CAS Name: 2-[[[[(E)-3-(4-chlorophenyl)-1-oxoprop-2-enyl]amino]-sulfanylidenemethyl]amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[[(E)-3-(4-chlorophenyl)prop-2-enoyl]carbamothioylamino]acetate Traditional Name: 2-[[(E)-3-(4-chlorophenyl)acryloyl]thiocarbamoylamino]acetic acid ethyl ester Formula: C14H15ClN2O3S MolecularWeight: 326.7985

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CNC(=S)NC(=O)C=CC1=CC=C(C=C1)Cl

Isomeric SMILES

CCOC(=O)CNC(=S)NC(=O)/C=C/C1=CC=C(C=C1)Cl

InChI

InChI=1S/C14H15ClN2O3S/c1-2-20-13(19)9-16-14(21)17-12(18)8-5-10-3-6-11(15)7-4-10/h3-8H,2,9H2,1H3,(H2,16,17,18,21)/b8-5+