2-[4-(4-ethenylphenyl)sulfonyl-2-methyl-1-[[1-(2-methylpyridin-4-yl)piperidin-4-yl]amino]-6-oxidanylidene-piperazin-2-yl]ethanoate

Systemtic Name: 2-[4-(4-ethenylphenyl)sulfonyl-2-methyl-1-[[1-(2-methylpyridin-4-yl)piperidin-4-yl]amino]-6-oxidanylidene-piperazin-2-yl]ethanoate Openeye Name: 2-[2-methyl-1-[[1-(2-methyl-4-pyridyl)-4-piperidyl]amino]-6-oxo-4-(4-vinylphenyl)sulfonyl-piperazin-2-yl]acetate CAS Name: 2-[4-(4-ethenylphenyl)sulfonyl-2-methyl-1-[[1-(2-methyl-4-pyridinyl)-4-piperidinyl]amino]-6-oxo-2-piperazinyl]acetate IUPAC Name: 2-[4-(4-ethenylphenyl)sulfonyl-2-methyl-1-[[1-(2-methylpyridin-4-yl)piperidin-4-yl]amino]-6-oxopiperazin-2-yl]acetate Traditional Name: 2-[6-keto-2-methyl-1-[[1-(2-methyl-4-pyridyl)-4-piperidyl]amino]-4-(4-vinylphenyl)sulfonyl-piperazin-2-yl]acetate Formula: C26H32N5O5S- MolecularWeight: 526.62778

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=CC(=C1)N2CCC(CC2)NN3C(=O)CN(CC3(C)CC(=O)[O-])S(=O)(=O)C4=CC=C(C=C4)C=C

Isomeric SMILES

CC1=NC=CC(=C1)N2CCC(CC2)NN3C(=O)CN(CC3(C)CC(=O)[O-])S(=O)(=O)C4=CC=C(C=C4)C=C

InChI

InChI=1S/C26H33N5O5S/c1-4-20-5-7-23(8-6-20)37(35,36)30-17-24(32)31(26(3,18-30)16-25(33)34)28-21-10-13-29(14-11-21)22-9-12-27-19(2)15-22/h4-9,12,15,21,28H,1,10-11,13-14,16-18H2,2-3H3,(H,33,34)/p-1