N-(4-acetamido-3-chloranyl-phenyl)-3-methylsulfanyl-propanamide

Systemtic Name: N-(4-acetamido-3-chloranyl-phenyl)-3-methylsulfanyl-propanamide Openeye Name: N-(4-acetamido-3-chloro-phenyl)-3-methylsulfanyl-propanamide CAS Name: N-(4-acetamido-3-chlorophenyl)-3-(methylthio)propanamide IUPAC Name: N-(4-acetamido-3-chlorophenyl)-3-methylsulfanylpropanamide Traditional Name: N-(4-acetamido-3-chloro-phenyl)-3-(methylthio)propionamide Formula: C12H15ClN2O2S MolecularWeight: 286.7777

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=C(C=C1)NC(=O)CCSC)Cl

Isomeric SMILES

CC(=O)NC1=C(C=C(C=C1)NC(=O)CCSC)Cl

InChI

InChI=1S/C12H15ClN2O2S/c1-8(16)14-11-4-3-9(7-10(11)13)15-12(17)5-6-18-2/h3-4,7H,5-6H2,1-2H3,(H,14,16)(H,15,17)