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

Systemtic Name: methyl 4-(6-chloranylnaphthalen-2-yl)sulfonyl-1-[[1-(2-methylpyridin-4-yl)piperidin-4-yl]amino]-6-oxidanylidene-piperazine-2-carboxylate Openeye Name: methyl 4-[(6-chloro-2-naphthyl)sulfonyl]-1-[[1-(2-methyl-4-pyridyl)-4-piperidyl]amino]-6-oxo-piperazine-2-carboxylate CAS Name: 4-[(6-chloro-2-naphthalenyl)sulfonyl]-1-[[1-(2-methyl-4-pyridinyl)-4-piperidinyl]amino]-6-oxo-2-piperazinecarboxylic acid methyl ester IUPAC Name: methyl 4-(6-chloronaphthalen-2-yl)sulfonyl-1-[[1-(2-methylpyridin-4-yl)piperidin-4-yl]amino]-6-oxopiperazine-2-carboxylate Traditional Name: 4-[(6-chloro-2-naphthyl)sulfonyl]-6-keto-1-[[1-(2-methyl-4-pyridyl)-4-piperidyl]amino]piperazine-2-carboxylic acid methyl ester Formula: C27H30ClN5O5S MolecularWeight: 572.0756

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=CC(=C1)N2CCC(CC2)NN3C(CN(CC3=O)S(=O)(=O)C4=CC5=C(C=C4)C=C(C=C5)Cl)C(=O)OC

Isomeric SMILES

CC1=NC=CC(=C1)N2CCC(CC2)NN3C(CN(CC3=O)S(=O)(=O)C4=CC5=C(C=C4)C=C(C=C5)Cl)C(=O)OC

InChI

InChI=1S/C27H30ClN5O5S/c1-18-13-23(7-10-29-18)31-11-8-22(9-12-31)30-33-25(27(35)38-2)16-32(17-26(33)34)39(36,37)24-6-4-19-14-21(28)5-3-20(19)15-24/h3-7,10,13-15,22,25,30H,8-9,11-12,16-17H2,1-2H3