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

Systemtic Name: (6S)-2-[(3-methoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methylamino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile Openeye Name: (6S)-2-[(3-methoxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)methylamino]-6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carbonitrile CAS Name: (6S)-2-[(3-methoxy-4-oxo-1-cyclohexa-2,5-dienylidene)methylamino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile IUPAC Name: (6S)-2-[(3-methoxy-4-oxocyclohexa-2,5-dien-1-ylidene)methylamino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile Traditional Name: (6S)-2-[(4-keto-3-methoxy-cyclohexa-2,5-dien-1-ylidene)methylamino]-6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carbonitrile Formula: C18H18N2O2S MolecularWeight: 326.41272

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC(=C2C#N)NC=C3C=CC(=O)C(=C3)OC

Isomeric SMILES

C[C@H]1CCC2=C(C1)SC(=C2C#N)NC=C3C=CC(=O)C(=C3)OC

InChI

InChI=1S/C18H18N2O2S/c1-11-3-5-13-14(9-19)18(23-17(13)7-11)20-10-12-4-6-15(21)16(8-12)22-2/h4,6,8,10-11,20H,3,5,7H2,1-2H3/t11-/m0/s1