6-methyl-2-[(2-oxidanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile

Systemtic Name: 6-methyl-2-[(2-oxidanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile Openeye Name: 2-[(2-hydroxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)methylamino]-6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carbonitrile CAS Name: 2-[(2-hydroxy-4-oxo-1-cyclohexa-2,5-dienylidene)methylamino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile IUPAC Name: 2-[(2-hydroxy-4-oxocyclohexa-2,5-dien-1-ylidene)methylamino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile Traditional Name: 2-[(2-hydroxy-4-keto-cyclohexa-2,5-dien-1-ylidene)methylamino]-6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carbonitrile Formula: C17H16N2O2S MolecularWeight: 312.38614

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC(=C2C#N)NC=C3C=CC(=O)C=C3O

Isomeric SMILES

CC1CCC2=C(C1)SC(=C2C#N)NC=C3C=CC(=O)C=C3O

InChI

InChI=1S/C17H16N2O2S/c1-10-2-5-13-14(8-18)17(22-16(13)6-10)19-9-11-3-4-12(20)7-15(11)21/h3-4,7,9-10,19,21H,2,5-6H2,1H3