methyl 2-[[(E)-3-(4-chlorophenyl)prop-2-enoyl]carbamothioyl-methyl-amino]ethanoate

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

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)OC)C(=S)NC(=O)C=CC1=CC=C(C=C1)Cl

Isomeric SMILES

CN(CC(=O)OC)C(=S)NC(=O)/C=C/C1=CC=C(C=C1)Cl

InChI

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