4-(3-cyanophenyl)-N-methyl-N-[4-[[(3S)-3-methylpiperazin-1-yl]methyl]phenyl]piperidine-1-carboxamide

Systemtic Name: 4-(3-cyanophenyl)-N-methyl-N-[4-[[(3S)-3-methylpiperazin-1-yl]methyl]phenyl]piperidine-1-carboxamide Openeye Name: 4-(3-cyanophenyl)-N-methyl-N-[4-[[(3S)-3-methylpiperazin-1-yl]methyl]phenyl]piperidine-1-carboxamide CAS Name: 4-(3-cyanophenyl)-N-methyl-N-[4-[[(3S)-3-methyl-1-piperazinyl]methyl]phenyl]-1-piperidinecarboxamide IUPAC Name: 4-(3-cyanophenyl)-N-methyl-N-[4-[[(3S)-3-methylpiperazin-1-yl]methyl]phenyl]piperidine-1-carboxamide Traditional Name: 4-(3-cyanophenyl)-N-methyl-N-[4-[[(3S)-3-methylpiperazino]methyl]phenyl]piperidine-1-carboxamide Formula: C26H33N5O MolecularWeight: 431.57312

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1)CC2=CC=C(C=C2)N(C)C(=O)N3CCC(CC3)C4=CC=CC(=C4)C#N

Isomeric SMILES

C[C@H]1CN(CCN1)CC2=CC=C(C=C2)N(C)C(=O)N3CCC(CC3)C4=CC=CC(=C4)C#N

InChI

InChI=1S/C26H33N5O/c1-20-18-30(15-12-28-20)19-21-6-8-25(9-7-21)29(2)26(32)31-13-10-23(11-14-31)24-5-3-4-22(16-24)17-27/h3-9,16,20,23,28H,10-15,18-19H2,1-2H3/t20-/m0/s1