5-[4-[(E)-4-(6-methylpyridin-2-yl)-2-phenoxy-but-3-enyl]piperazin-1-yl]-2-phenyl-2-propan-2-yl-pentanenitrile

Systemtic Name: 5-[4-[(E)-4-(6-methylpyridin-2-yl)-2-phenoxy-but-3-enyl]piperazin-1-yl]-2-phenyl-2-propan-2-yl-pentanenitrile Openeye Name: 2-isopropyl-5-[4-[(E)-4-(6-methyl-2-pyridyl)-2-phenoxy-but-3-enyl]piperazin-1-yl]-2-phenyl-pentanenitrile CAS Name: 5-[4-[(E)-4-(6-methyl-2-pyridinyl)-2-phenoxybut-3-enyl]-1-piperazinyl]-2-phenyl-2-propan-2-ylpentanenitrile IUPAC Name: 5-[4-[(E)-4-(6-methylpyridin-2-yl)-2-phenoxybut-3-enyl]piperazin-1-yl]-2-phenyl-2-propan-2-ylpentanenitrile Traditional Name: 2-isopropyl-5-[4-[(E)-4-(6-methyl-2-pyridyl)-2-phenoxy-but-3-enyl]piperazino]-2-phenyl-valeronitrile Formula: C34H42N4O MolecularWeight: 522.72348

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=N1)C=CC(CN2CCN(CC2)CCCC(C#N)(C3=CC=CC=C3)C(C)C)OC4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC(=N1)/C=C/C(CN2CCN(CC2)CCCC(C#N)(C3=CC=CC=C3)C(C)C)OC4=CC=CC=C4

InChI

InChI=1S/C34H42N4O/c1-28(2)34(27-35,30-13-6-4-7-14-30)20-11-21-37-22-24-38(25-23-37)26-33(39-32-16-8-5-9-17-32)19-18-31-15-10-12-29(3)36-31/h4-10,12-19,28,33H,11,20-26H2,1-3H3/b19-18+