(3R)-N-[4-(4-cyanophenyl)-1,3-thiazol-2-yl]-1-oxidanylidene-3,4-dihydroisochromene-3-carboxamide

Systemtic Name: (3R)-N-[4-(4-cyanophenyl)-1,3-thiazol-2-yl]-1-oxidanylidene-3,4-dihydroisochromene-3-carboxamide Openeye Name: (3R)-N-[4-(4-cyanophenyl)thiazol-2-yl]-1-oxo-isochromane-3-carboxamide CAS Name: (3R)-N-[4-(4-cyanophenyl)-2-thiazolyl]-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxamide IUPAC Name: (3R)-N-[4-(4-cyanophenyl)-1,3-thiazol-2-yl]-1-oxo-3,4-dihydroisochromene-3-carboxamide Traditional Name: (3R)-N-[4-(4-cyanophenyl)thiazol-2-yl]-1-keto-isochroman-3-carboxamide Formula: C20H13N3O3S MolecularWeight: 375.40052

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H13N3O3S/c21-10-12-5-7-13(8-6-12)16-11-27-20(22-16)23-18(24)17-9-14-3-1-2-4-15(14)19(25)26-17/h1-8,11,17H,9H2,(H,22,23,24)/t17-/m1/s1