2-(1,3-benzodioxol-5-ylmethylideneamino)-6-(phenylmethyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carbonitrile

Systemtic Name: 2-(1,3-benzodioxol-5-ylmethylideneamino)-6-(phenylmethyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carbonitrile Openeye Name: 2-(1,3-benzodioxol-5-ylmethyleneamino)-6-benzyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carbonitrile CAS Name: 2-(1,3-benzodioxol-5-ylmethylideneamino)-6-(phenylmethyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carbonitrile IUPAC Name: 2-(1,3-benzodioxol-5-ylmethylideneamino)-6-benzyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carbonitrile Traditional Name: 6-benzyl-2-(piperonylideneamino)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carbonitrile Formula: C23H19N3O2S MolecularWeight: 401.48086

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=C1C(=C(S2)N=CC3=CC4=C(C=C3)OCO4)C#N)CC5=CC=CC=C5

Isomeric SMILES

C1CN(CC2=C1C(=C(S2)N=CC3=CC4=C(C=C3)OCO4)C#N)CC5=CC=CC=C5

InChI

InChI=1S/C23H19N3O2S/c24-11-19-18-8-9-26(13-16-4-2-1-3-5-16)14-22(18)29-23(19)25-12-17-6-7-20-21(10-17)28-15-27-20/h1-7,10,12H,8-9,13-15H2