(3S,4R)-2,2-dimethyl-3-oxidanyl-4-[(2-oxidanylidene-1H-pyridin-4-yl)oxy]-3,4-dihydrochromene-6-carbothioamide

Systemtic Name: (3S,4R)-2,2-dimethyl-3-oxidanyl-4-[(2-oxidanylidene-1H-pyridin-4-yl)oxy]-3,4-dihydrochromene-6-carbothioamide Openeye Name: (3S,4R)-3-hydroxy-2,2-dimethyl-4-[(2-oxo-1H-pyridin-4-yl)oxy]chromane-6-carbothioamide CAS Name: (3S,4R)-3-hydroxy-2,2-dimethyl-4-[(2-oxo-1H-pyridin-4-yl)oxy]-3,4-dihydro-2H-1-benzopyran-6-carbothioamide IUPAC Name: (3S,4R)-3-hydroxy-2,2-dimethyl-4-[(2-oxo-1H-pyridin-4-yl)oxy]-3,4-dihydrochromene-6-carbothioamide Traditional Name: (3S,4R)-3-hydroxy-4-[(2-keto-1H-pyridin-4-yl)oxy]-2,2-dimethyl-chroman-6-carbothioamide Formula: C17H18N2O4S MolecularWeight: 346.40082

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=C(O1)C=CC(=C2)C(=S)N)OC3=CC(=O)NC=C3)O)C

Isomeric SMILES

CC1([C@H]([C@@H](C2=C(O1)C=CC(=C2)C(=S)N)OC3=CC(=O)NC=C3)O)C

InChI

InChI=1S/C17H18N2O4S/c1-17(2)15(21)14(22-10-5-6-19-13(20)8-10)11-7-9(16(18)24)3-4-12(11)23-17/h3-8,14-15,21H,1-2H3,(H2,18,24)(H,19,20)/t14-,15+/m1/s1