4-(4-ethenylphenyl)sulfonyl-1-[(1-pyridin-4-ylpiperidin-4-yl)amino]piperazin-2-one

Systemtic Name: 4-(4-ethenylphenyl)sulfonyl-1-[(1-pyridin-4-ylpiperidin-4-yl)amino]piperazin-2-one Openeye Name: 1-[[1-(4-pyridyl)-4-piperidyl]amino]-4-(4-vinylphenyl)sulfonyl-piperazin-2-one CAS Name: 4-(4-ethenylphenyl)sulfonyl-1-[(1-pyridin-4-yl-4-piperidinyl)amino]-2-piperazinone IUPAC Name: 4-(4-ethenylphenyl)sulfonyl-1-[(1-pyridin-4-ylpiperidin-4-yl)amino]piperazin-2-one Traditional Name: 1-[[1-(4-pyridyl)-4-piperidyl]amino]-4-(4-vinylphenyl)sulfonyl-piperazin-2-one Formula: C22H27N5O3S MolecularWeight: 441.54648

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27N5O3S/c1-2-18-3-5-21(6-4-18)31(29,30)26-15-16-27(22(28)17-26)24-19-9-13-25(14-10-19)20-7-11-23-12-8-20/h2-8,11-12,19,24H,1,9-10,13-17H2