(E)-3-[3,5-bis(dimethylamino)-4-piperidin-1-yl-phenyl]-4-phenylazanyl-but-3-enenitrile

Systemtic Name: (E)-3-[3,5-bis(dimethylamino)-4-piperidin-1-yl-phenyl]-4-phenylazanyl-but-3-enenitrile Openeye Name: (E)-4-anilino-3-[3,5-bis(dimethylamino)-4-(1-piperidyl)phenyl]but-3-enenitrile CAS Name: (E)-4-anilino-3-[3,5-bis(dimethylamino)-4-(1-piperidinyl)phenyl]-3-butenenitrile IUPAC Name: (E)-4-anilino-3-[3,5-bis(dimethylamino)-4-piperidin-1-ylphenyl]but-3-enenitrile Traditional Name: (E)-4-anilino-3-[3,5-bis(dimethylamino)-4-piperidino-phenyl]but-3-enenitrile Formula: C25H33N5 MolecularWeight: 403.56302

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC(=CC(=C1N2CCCCC2)N(C)C)C(=CNC3=CC=CC=C3)CC#N

Isomeric SMILES

CN(C)C1=CC(=CC(=C1N2CCCCC2)N(C)C)/C(=C/NC3=CC=CC=C3)/CC#N

InChI

InChI=1S/C25H33N5/c1-28(2)23-17-21(20(13-14-26)19-27-22-11-7-5-8-12-22)18-24(29(3)4)25(23)30-15-9-6-10-16-30/h5,7-8,11-12,17-19,27H,6,9-10,13,15-16H2,1-4H3/b20-19+