5-methyl-2-[(E)-(phenylmethylidene)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile

Systemtic Name: 5-methyl-2-[(E)-(phenylmethylidene)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile Openeye Name: 2-[(E)-benzylideneamino]-5-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carbonitrile CAS Name: 5-methyl-2-[(E)-(phenylmethylene)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile IUPAC Name: 2-[(E)-benzylideneamino]-5-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile Traditional Name: 2-[(E)-benzalamino]-5-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carbonitrile Formula: C17H16N2S MolecularWeight: 280.38734

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)C(=C(S2)N=CC3=CC=CC=C3)C#N

Isomeric SMILES

CC1CCC2=C(C1)C(=C(S2)/N=C/C3=CC=CC=C3)C#N

InChI

InChI=1S/C17H16N2S/c1-12-7-8-16-14(9-12)15(10-18)17(20-16)19-11-13-5-3-2-4-6-13/h2-6,11-12H,7-9H2,1H3/b19-11+