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

Systemtic Name: methyl 4-(4-ethenylphenyl)sulfonyl-1-[methyl-[1-(2-methylpyridin-4-yl)piperidin-4-yl]amino]-6-oxidanylidene-piperazine-2-carboxylate Openeye Name: methyl 1-[methyl-[1-(2-methyl-4-pyridyl)-4-piperidyl]amino]-6-oxo-4-(4-vinylphenyl)sulfonyl-piperazine-2-carboxylate CAS Name: 4-(4-ethenylphenyl)sulfonyl-1-[methyl-[1-(2-methyl-4-pyridinyl)-4-piperidinyl]amino]-6-oxo-2-piperazinecarboxylic acid methyl ester IUPAC Name: methyl 4-(4-ethenylphenyl)sulfonyl-1-[methyl-[1-(2-methylpyridin-4-yl)piperidin-4-yl]amino]-6-oxopiperazine-2-carboxylate Traditional Name: 6-keto-1-[methyl-[1-(2-methyl-4-pyridyl)-4-piperidyl]amino]-4-(4-vinylphenyl)sulfonyl-piperazine-2-carboxylic acid methyl ester Formula: C26H33N5O5S MolecularWeight: 527.63572

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=CC(=C1)N2CCC(CC2)N(C)N3C(CN(CC3=O)S(=O)(=O)C4=CC=C(C=C4)C=C)C(=O)OC

Isomeric SMILES

CC1=NC=CC(=C1)N2CCC(CC2)N(C)N3C(CN(CC3=O)S(=O)(=O)C4=CC=C(C=C4)C=C)C(=O)OC

InChI

InChI=1S/C26H33N5O5S/c1-5-20-6-8-23(9-7-20)37(34,35)30-17-24(26(33)36-4)31(25(32)18-30)28(3)21-11-14-29(15-12-21)22-10-13-27-19(2)16-22/h5-10,13,16,21,24H,1,11-12,14-15,17-18H2,2-4H3