4-[(E)-2-(4-methylphenyl)ethenyl]sulfonyl-1-[(1-pyridin-4-ylpiperidin-4-yl)amino]piperazin-2-one

Systemtic Name: 4-[(E)-2-(4-methylphenyl)ethenyl]sulfonyl-1-[(1-pyridin-4-ylpiperidin-4-yl)amino]piperazin-2-one Openeye Name: 4-[(E)-2-(p-tolyl)vinyl]sulfonyl-1-[[1-(4-pyridyl)-4-piperidyl]amino]piperazin-2-one CAS Name: 4-[(E)-2-(4-methylphenyl)ethenyl]sulfonyl-1-[(1-pyridin-4-yl-4-piperidinyl)amino]-2-piperazinone IUPAC Name: 4-[(E)-2-(4-methylphenyl)ethenyl]sulfonyl-1-[(1-pyridin-4-ylpiperidin-4-yl)amino]piperazin-2-one Traditional Name: 4-[(E)-2-(p-tolyl)vinyl]sulfonyl-1-[[1-(4-pyridyl)-4-piperidyl]amino]piperazin-2-one Formula: C23H29N5O3S MolecularWeight: 455.57306

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C=CS(=O)(=O)N2CCN(C(=O)C2)NC3CCN(CC3)C4=CC=NC=C4

Isomeric SMILES

CC1=CC=C(C=C1)/C=C/S(=O)(=O)N2CCN(C(=O)C2)NC3CCN(CC3)C4=CC=NC=C4

InChI

InChI=1S/C23H29N5O3S/c1-19-2-4-20(5-3-19)10-17-32(30,31)27-15-16-28(23(29)18-27)25-21-8-13-26(14-9-21)22-6-11-24-12-7-22/h2-7,10-12,17,21,25H,8-9,13-16,18H2,1H3/b17-10+