2,2,3-trimethyl-3-oxidanyl-4-(5-oxidanylidene-6-sulfanylidene-2H-pyridin-1-yl)-4H-chromene-6-carbonitrile

Systemtic Name: 2,2,3-trimethyl-3-oxidanyl-4-(5-oxidanylidene-6-sulfanylidene-2H-pyridin-1-yl)-4H-chromene-6-carbonitrile Openeye Name: 3-hydroxy-2,2,3-trimethyl-4-(5-oxo-6-thioxo-2H-pyridin-1-yl)chromane-6-carbonitrile CAS Name: 3-hydroxy-2,2,3-trimethyl-4-(5-oxo-6-sulfanylidene-2H-pyridin-1-yl)-3,4-dihydro-2H-1-benzopyran-6-carbonitrile IUPAC Name: 3-hydroxy-2,2,3-trimethyl-4-(5-oxo-6-sulfanylidene-2H-pyridin-1-yl)-4H-chromene-6-carbonitrile Traditional Name: 3-hydroxy-4-(5-keto-6-thioxo-2H-pyridin-1-yl)-2,2,3-trimethyl-chroman-6-carbonitrile Formula: C18H18N2O3S MolecularWeight: 342.41212

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=C(O1)C=CC(=C2)C#N)N3CC=CC(=O)C3=S)(C)O)C

Isomeric SMILES

CC1(C(C(C2=C(O1)C=CC(=C2)C#N)N3CC=CC(=O)C3=S)(C)O)C

InChI

InChI=1S/C18H18N2O3S/c1-17(2)18(3,22)15(20-8-4-5-13(21)16(20)24)12-9-11(10-19)6-7-14(12)23-17/h4-7,9,15,22H,8H2,1-3H3