(3R,8aS)-N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]-2-oxidanylidene-3,8a-dihydrochromene-3-carboxamide

Systemtic Name: (3R,8aS)-N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]-2-oxidanylidene-3,8a-dihydrochromene-3-carboxamide Openeye Name: (3R,8aS)-N-[4-(2-methylthiazol-4-yl)phenyl]-2-oxo-3,8a-dihydrochromene-3-carboxamide CAS Name: (3R,8aS)-N-[4-(2-methyl-4-thiazolyl)phenyl]-2-oxo-3,8a-dihydro-1-benzopyran-3-carboxamide IUPAC Name: (3R,8aS)-N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]-2-oxo-3,8a-dihydrochromene-3-carboxamide Traditional Name: (3R,8aS)-2-keto-N-[4-(2-methylthiazol-4-yl)phenyl]-3,8a-dihydrochromene-3-carboxamide Formula: C20H16N2O3S MolecularWeight: 364.41764

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)C2=CC=C(C=C2)NC(=O)C3C=C4C=CC=CC4OC3=O

Isomeric SMILES

CC1=NC(=CS1)C2=CC=C(C=C2)NC(=O)[C@H]3C=C4C=CC=C[C@@H]4OC3=O

InChI

InChI=1S/C20H16N2O3S/c1-12-21-17(11-26-12)13-6-8-15(9-7-13)22-19(23)16-10-14-4-2-3-5-18(14)25-20(16)24/h2-11,16,18H,1H3,(H,22,23)/t16-,18+/m1/s1