2-[4-[4-[(4-cyanophenyl)methyl]piperazin-1-yl]carbonylpiperidin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 2-[4-[4-[(4-cyanophenyl)methyl]piperazin-1-yl]carbonylpiperidin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 2-[[4-[4-[(4-cyanophenyl)methyl]piperazine-1-carbonyl]-1-piperidyl]sulfonyl]benzonitrile CAS Name: 2-[[4-[[4-[(4-cyanophenyl)methyl]-1-piperazinyl]-oxomethyl]-1-piperidinyl]sulfonyl]benzonitrile IUPAC Name: 2-[4-[4-[(4-cyanophenyl)methyl]piperazine-1-carbonyl]piperidin-1-yl]sulfonylbenzonitrile Traditional Name: 2-[4-[4-(4-cyanobenzyl)piperazine-1-carbonyl]piperidino]sulfonylbenzonitrile Formula: C25H27N5O3S MolecularWeight: 477.57858

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N2CCN(CC2)CC3=CC=C(C=C3)C#N)S(=O)(=O)C4=CC=CC=C4C#N

Isomeric SMILES

C1CN(CCC1C(=O)N2CCN(CC2)CC3=CC=C(C=C3)C#N)S(=O)(=O)C4=CC=CC=C4C#N

InChI

InChI=1S/C25H27N5O3S/c26-17-20-5-7-21(8-6-20)19-28-13-15-29(16-14-28)25(31)22-9-11-30(12-10-22)34(32,33)24-4-2-1-3-23(24)18-27/h1-8,22H,9-16,19H2