N-(1-methylsulfanyl-4-oxidanylidene-pentan-3-yl)-2-phenyl-4-(1,3-thiazol-2-ylcarbonyl)benzamide

Systemtic Name: N-(1-methylsulfanyl-4-oxidanylidene-pentan-3-yl)-2-phenyl-4-(1,3-thiazol-2-ylcarbonyl)benzamide Openeye Name: N-[1-(2-methylsulfanylethyl)-2-oxo-propyl]-2-phenyl-4-(thiazole-2-carbonyl)benzamide CAS Name: N-[1-(methylthio)-4-oxopentan-3-yl]-4-[oxo(2-thiazolyl)methyl]-2-phenylbenzamide IUPAC Name: N-(1-methylsulfanyl-4-oxopentan-3-yl)-2-phenyl-4-(1,3-thiazole-2-carbonyl)benzamide Traditional Name: N-[2-keto-1-[2-(methylthio)ethyl]propyl]-2-phenyl-4-(thiazole-2-carbonyl)benzamide Formula: C23H22N2O3S2 MolecularWeight: 438.56238

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(CCSC)NC(=O)C1=C(C=C(C=C1)C(=O)C2=NC=CS2)C3=CC=CC=C3

Isomeric SMILES

CC(=O)C(CCSC)NC(=O)C1=C(C=C(C=C1)C(=O)C2=NC=CS2)C3=CC=CC=C3

InChI

InChI=1S/C23H22N2O3S2/c1-15(26)20(10-12-29-2)25-22(28)18-9-8-17(21(27)23-24-11-13-30-23)14-19(18)16-6-4-3-5-7-16/h3-9,11,13-14,20H,10,12H2,1-2H3,(H,25,28)