(3S)-N-[4-(2-methoxy-5-methyl-phenyl)-1,3-thiazol-2-yl]-3-methyl-1-oxidanylidene-4H-isochromene-3-carboxamide

Systemtic Name: (3S)-N-[4-(2-methoxy-5-methyl-phenyl)-1,3-thiazol-2-yl]-3-methyl-1-oxidanylidene-4H-isochromene-3-carboxamide Openeye Name: (3S)-N-[4-(2-methoxy-5-methyl-phenyl)thiazol-2-yl]-3-methyl-1-oxo-isochromane-3-carboxamide CAS Name: (3S)-N-[4-(2-methoxy-5-methylphenyl)-2-thiazolyl]-3-methyl-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxamide IUPAC Name: (3S)-N-[4-(2-methoxy-5-methylphenyl)-1,3-thiazol-2-yl]-3-methyl-1-oxo-4H-isochromene-3-carboxamide Traditional Name: (3S)-1-keto-N-[4-(2-methoxy-5-methyl-phenyl)thiazol-2-yl]-3-methyl-isochroman-3-carboxamide Formula: C22H20N2O4S MolecularWeight: 408.4702

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)C2=CSC(=N2)NC(=O)C3(CC4=CC=CC=C4C(=O)O3)C

Isomeric SMILES

CC1=CC(=C(C=C1)OC)C2=CSC(=N2)NC(=O)[C@@]3(CC4=CC=CC=C4C(=O)O3)C

InChI

InChI=1S/C22H20N2O4S/c1-13-8-9-18(27-3)16(10-13)17-12-29-21(23-17)24-20(26)22(2)11-14-6-4-5-7-15(14)19(25)28-22/h4-10,12H,11H2,1-3H3,(H,23,24,26)/t22-/m0/s1