2-[2-[di(propan-2-yl)amino]ethyl]-4-(4-methylpiperazin-1-yl)-2-naphthalen-1-yl-butanenitrile

Systemtic Name: 2-[2-[di(propan-2-yl)amino]ethyl]-4-(4-methylpiperazin-1-yl)-2-naphthalen-1-yl-butanenitrile Openeye Name: 2-[2-(diisopropylamino)ethyl]-4-(4-methylpiperazin-1-yl)-2-(1-naphthyl)butanenitrile CAS Name: 2-[2-[di(propan-2-yl)amino]ethyl]-4-(4-methyl-1-piperazinyl)-2-(1-naphthalenyl)butanenitrile IUPAC Name: 2-[2-[di(propan-2-yl)amino]ethyl]-4-(4-methylpiperazin-1-yl)-2-naphthalen-1-ylbutanenitrile Traditional Name: 2-[2-(diisopropylamino)ethyl]-4-(4-methylpiperazino)-2-(1-naphthyl)butyronitrile Formula: C27H40N4 MolecularWeight: 420.6333

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CCC(CCN1CCN(CC1)C)(C#N)C2=CC=CC3=CC=CC=C32)C(C)C

Isomeric SMILES

CC(C)N(CCC(CCN1CCN(CC1)C)(C#N)C2=CC=CC3=CC=CC=C32)C(C)C

InChI

InChI=1S/C27H40N4/c1-22(2)31(23(3)4)16-14-27(21-28,13-15-30-19-17-29(5)18-20-30)26-12-8-10-24-9-6-7-11-25(24)26/h6-12,22-23H,13-20H2,1-5H3