7-[cyclohexyl(phenyl)amino]-2-phenyl-6-piperazin-1-yl-2-propan-2-yl-heptanenitrile

Systemtic Name: 7-[cyclohexyl(phenyl)amino]-2-phenyl-6-piperazin-1-yl-2-propan-2-yl-heptanenitrile Openeye Name: 7-(N-cyclohexylanilino)-2-isopropyl-2-phenyl-6-piperazin-1-yl-heptanenitrile CAS Name: 7-(N-cyclohexylanilino)-2-phenyl-6-(1-piperazinyl)-2-propan-2-ylheptanenitrile IUPAC Name: 7-(N-cyclohexylanilino)-2-phenyl-6-piperazin-1-yl-2-propan-2-ylheptanenitrile Traditional Name: 7-(N-cyclohexylanilino)-2-isopropyl-2-phenyl-6-piperazino-enanthonitrile Formula: C32H46N4 MolecularWeight: 486.73444

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CCCC(CN(C1CCCCC1)C2=CC=CC=C2)N3CCNCC3)(C#N)C4=CC=CC=C4

Isomeric SMILES

CC(C)C(CCCC(CN(C1CCCCC1)C2=CC=CC=C2)N3CCNCC3)(C#N)C4=CC=CC=C4

InChI

InChI=1S/C32H46N4/c1-27(2)32(26-33,28-13-6-3-7-14-28)20-12-19-31(35-23-21-34-22-24-35)25-36(29-15-8-4-9-16-29)30-17-10-5-11-18-30/h3-4,6-9,13-16,27,30-31,34H,5,10-12,17-25H2,1-2H3