2-[(3E)-3-[(4-methoxyphenyl)methylidene]-2-oxidanylidene-pyrrolidin-1-yl]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile

Systemtic Name: 2-[(3E)-3-[(4-methoxyphenyl)methylidene]-2-oxidanylidene-pyrrolidin-1-yl]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile Openeye Name: 2-[(3E)-3-[(4-methoxyphenyl)methylene]-2-oxo-pyrrolidin-1-yl]-6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carbonitrile CAS Name: 2-[(3E)-3-[(4-methoxyphenyl)methylidene]-2-oxo-1-pyrrolidinyl]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile IUPAC Name: 2-[(3E)-3-[(4-methoxyphenyl)methylidene]-2-oxopyrrolidin-1-yl]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile Traditional Name: 2-[(3E)-2-keto-3-p-anisylidene-pyrrolidino]-6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carbonitrile Formula: C22H22N2O2S MolecularWeight: 378.48728

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC(=C2C#N)N3CCC(=CC4=CC=C(C=C4)OC)C3=O

Isomeric SMILES

CC1CCC2=C(C1)SC(=C2C#N)N3CC/C(=C\C4=CC=C(C=C4)OC)/C3=O

InChI

InChI=1S/C22H22N2O2S/c1-14-3-8-18-19(13-23)22(27-20(18)11-14)24-10-9-16(21(24)25)12-15-4-6-17(26-2)7-5-15/h4-7,12,14H,3,8-11H2,1-2H3/b16-12+