2,2-dimethyl-3-oxidanyl-4-[(2-oxidanylidene-1H-pyridin-4-yl)sulfanyl]-3,4-dihydrochromene-6-carbonitrile

Systemtic Name: 2,2-dimethyl-3-oxidanyl-4-[(2-oxidanylidene-1H-pyridin-4-yl)sulfanyl]-3,4-dihydrochromene-6-carbonitrile Openeye Name: 3-hydroxy-2,2-dimethyl-4-[(2-oxo-1H-pyridin-4-yl)sulfanyl]chromane-6-carbonitrile CAS Name: 3-hydroxy-2,2-dimethyl-4-[(2-oxo-1H-pyridin-4-yl)thio]-3,4-dihydro-2H-1-benzopyran-6-carbonitrile IUPAC Name: 3-hydroxy-2,2-dimethyl-4-[(2-oxo-1H-pyridin-4-yl)sulfanyl]-3,4-dihydrochromene-6-carbonitrile Traditional Name: 3-hydroxy-4-[(2-keto-1H-pyridin-4-yl)thio]-2,2-dimethyl-chroman-6-carbonitrile Formula: C17H16N2O3S MolecularWeight: 328.38554

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=C(O1)C=CC(=C2)C#N)SC3=CC(=O)NC=C3)O)C

Isomeric SMILES

CC1(C(C(C2=C(O1)C=CC(=C2)C#N)SC3=CC(=O)NC=C3)O)C

InChI

InChI=1S/C17H16N2O3S/c1-17(2)16(21)15(23-11-5-6-19-14(20)8-11)12-7-10(9-18)3-4-13(12)22-17/h3-8,15-16,21H,1-2H3,(H,19,20)