6,6-dimethyl-7-oxidanyl-8-[(6-oxidanylidene-1H-pyridazin-3-yl)sulfanyl]-7,8-dihydro-5H-naphthalene-2-carbonitrile

Systemtic Name: 6,6-dimethyl-7-oxidanyl-8-[(6-oxidanylidene-1H-pyridazin-3-yl)sulfanyl]-7,8-dihydro-5H-naphthalene-2-carbonitrile Openeye Name: 3-hydroxy-2,2-dimethyl-4-[(6-oxo-1H-pyridazin-3-yl)sulfanyl]tetralin-6-carbonitrile CAS Name: 7-hydroxy-6,6-dimethyl-8-[(6-oxo-1H-pyridazin-3-yl)thio]-7,8-dihydro-5H-naphthalene-2-carbonitrile IUPAC Name: 7-hydroxy-6,6-dimethyl-8-[(6-oxo-1H-pyridazin-3-yl)sulfanyl]-7,8-dihydro-5H-naphthalene-2-carbonitrile Traditional Name: 3-hydroxy-4-[(6-keto-1H-pyridazin-3-yl)thio]-2,2-dimethyl-tetralin-6-carbonitrile Formula: C17H17N3O2S MolecularWeight: 327.40078

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C=C(C=C2)C#N)C(C1O)SC3=NNC(=O)C=C3)C

Isomeric SMILES

CC1(CC2=C(C=C(C=C2)C#N)C(C1O)SC3=NNC(=O)C=C3)C

InChI

InChI=1S/C17H17N3O2S/c1-17(2)8-11-4-3-10(9-18)7-12(11)15(16(17)22)23-14-6-5-13(21)19-20-14/h3-7,15-16,22H,8H2,1-2H3,(H,19,21)