(3S)-1-oxidanylidene-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-3,4-dihydroisochromene-3-carboxamide

Systemtic Name: (3S)-1-oxidanylidene-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-3,4-dihydroisochromene-3-carboxamide Openeye Name: (3S)-1-oxo-N-[4-(2-pyridyl)thiazol-2-yl]isochromane-3-carboxamide CAS Name: (3S)-1-oxo-N-[4-(2-pyridinyl)-2-thiazolyl]-3,4-dihydro-1H-2-benzopyran-3-carboxamide IUPAC Name: (3S)-1-oxo-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-3,4-dihydroisochromene-3-carboxamide Traditional Name: (3S)-1-keto-N-[4-(2-pyridyl)thiazol-2-yl]isochroman-3-carboxamide Formula: C18H13N3O3S MolecularWeight: 351.37912

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC(=O)C2=CC=CC=C21)C(=O)NC3=NC(=CS3)C4=CC=CC=N4

Isomeric SMILES

C1[C@H](OC(=O)C2=CC=CC=C21)C(=O)NC3=NC(=CS3)C4=CC=CC=N4

InChI

InChI=1S/C18H13N3O3S/c22-16(15-9-11-5-1-2-6-12(11)17(23)24-15)21-18-20-14(10-25-18)13-7-3-4-8-19-13/h1-8,10,15H,9H2,(H,20,21,22)/t15-/m0/s1