(3S)-3-methyl-N-(4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)-1-oxidanylidene-4H-isochromene-3-carboxamide

Systemtic Name: (3S)-3-methyl-N-(4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)-1-oxidanylidene-4H-isochromene-3-carboxamide Openeye Name: (3S)-3-methyl-N-[4-methyl-5-(2-pyridyl)thiazol-2-yl]-1-oxo-isochromane-3-carboxamide CAS Name: (3S)-3-methyl-N-[4-methyl-5-(2-pyridinyl)-2-thiazolyl]-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxamide IUPAC Name: (3S)-3-methyl-N-(4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)-1-oxo-4H-isochromene-3-carboxamide Traditional Name: (3S)-1-keto-3-methyl-N-[4-methyl-5-(2-pyridyl)thiazol-2-yl]isochroman-3-carboxamide Formula: C20H17N3O3S MolecularWeight: 379.43228

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)C2(CC3=CC=CC=C3C(=O)O2)C)C4=CC=CC=N4

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)[C@@]2(CC3=CC=CC=C3C(=O)O2)C)C4=CC=CC=N4

InChI

InChI=1S/C20H17N3O3S/c1-12-16(15-9-5-6-10-21-15)27-19(22-12)23-18(25)20(2)11-13-7-3-4-8-14(13)17(24)26-20/h3-10H,11H2,1-2H3,(H,22,23,25)/t20-/m0/s1