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

Systemtic Name: 2-phenyl-7-[(phenylmethyl)-propan-2-yl-amino]-6-piperazin-1-yl-2-propan-2-yl-heptanenitrile Openeye Name: 7-[benzyl(isopropyl)amino]-2-isopropyl-2-phenyl-6-piperazin-1-yl-heptanenitrile CAS Name: 2-phenyl-7-[(phenylmethyl)-propan-2-ylamino]-6-(1-piperazinyl)-2-propan-2-ylheptanenitrile IUPAC Name: 7-[benzyl(propan-2-yl)amino]-2-phenyl-6-piperazin-1-yl-2-propan-2-ylheptanenitrile Traditional Name: 7-[benzyl(isopropyl)amino]-2-isopropyl-2-phenyl-6-piperazino-enanthonitrile Formula: C30H44N4 MolecularWeight: 460.69716

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CCCC(CN(CC1=CC=CC=C1)C(C)C)N2CCNCC2)(C#N)C3=CC=CC=C3

Isomeric SMILES

CC(C)C(CCCC(CN(CC1=CC=CC=C1)C(C)C)N2CCNCC2)(C#N)C3=CC=CC=C3

InChI

InChI=1S/C30H44N4/c1-25(2)30(24-31,28-14-9-6-10-15-28)17-11-16-29(33-20-18-32-19-21-33)23-34(26(3)4)22-27-12-7-5-8-13-27/h5-10,12-15,25-26,29,32H,11,16-23H2,1-4H3