3-(2-chlorophenyl)-N-[(3-cyano-4,6-dimethyl-2-oxidanylidene-pyridin-1-yl)carbamothioyl]propanamide

Systemtic Name: 3-(2-chlorophenyl)-N-[(3-cyano-4,6-dimethyl-2-oxidanylidene-pyridin-1-yl)carbamothioyl]propanamide Openeye Name: 3-(2-chlorophenyl)-N-[(3-cyano-4,6-dimethyl-2-oxo-1-pyridyl)carbamothioyl]propanamide CAS Name: 3-(2-chlorophenyl)-N-[[(3-cyano-4,6-dimethyl-2-oxo-1-pyridinyl)amino]-sulfanylidenemethyl]propanamide IUPAC Name: 3-(2-chlorophenyl)-N-[(3-cyano-4,6-dimethyl-2-oxopyridin-1-yl)carbamothioyl]propanamide Traditional Name: 3-(2-chlorophenyl)-N-[(3-cyano-2-keto-4,6-dimethyl-1-pyridyl)thiocarbamoyl]propionamide Formula: C18H17ClN4O2S MolecularWeight: 388.87118

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=O)N1NC(=S)NC(=O)CCC2=CC=CC=C2Cl)C#N)C

Isomeric SMILES

CC1=CC(=C(C(=O)N1NC(=S)NC(=O)CCC2=CC=CC=C2Cl)C#N)C

InChI

InChI=1S/C18H17ClN4O2S/c1-11-9-12(2)23(17(25)14(11)10-20)22-18(26)21-16(24)8-7-13-5-3-4-6-15(13)19/h3-6,9H,7-8H2,1-2H3,(H2,21,22,24,26)