4-[[4-[1-[(E)-2-phenylethenyl]sulfonylpiperidin-4-yl]carbonylpiperazin-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[[4-[1-[(E)-2-phenylethenyl]sulfonylpiperidin-4-yl]carbonylpiperazin-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[4-[1-[(E)-styryl]sulfonylpiperidine-4-carbonyl]piperazin-1-yl]methyl]benzonitrile CAS Name: 4-[[4-[oxo-[1-[(E)-2-phenylethenyl]sulfonyl-4-piperidinyl]methyl]-1-piperazinyl]methyl]benzonitrile IUPAC Name: 4-[[4-[1-[(E)-2-phenylethenyl]sulfonylpiperidine-4-carbonyl]piperazin-1-yl]methyl]benzonitrile Traditional Name: 4-[[4-[1-[(E)-styryl]sulfonylisonipecotoyl]piperazino]methyl]benzonitrile Formula: C26H30N4O3S MolecularWeight: 478.6064

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N2CCN(CC2)CC3=CC=C(C=C3)C#N)S(=O)(=O)C=CC4=CC=CC=C4

Isomeric SMILES

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

InChI

InChI=1S/C26H30N4O3S/c27-20-23-6-8-24(9-7-23)21-28-15-17-29(18-16-28)26(31)25-10-13-30(14-11-25)34(32,33)19-12-22-4-2-1-3-5-22/h1-9,12,19,25H,10-11,13-18,21H2/b19-12+