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

Systemtic Name: methyl 4-(6-chloranylnaphthalen-2-yl)sulfonyl-1-[methyl-(1-pyridin-4-ylpiperidin-4-yl)amino]-6-oxidanylidene-piperazine-2-carboxylate Openeye Name: methyl 4-[(6-chloro-2-naphthyl)sulfonyl]-1-[methyl-[1-(4-pyridyl)-4-piperidyl]amino]-6-oxo-piperazine-2-carboxylate CAS Name: 4-[(6-chloro-2-naphthalenyl)sulfonyl]-1-[methyl-(1-pyridin-4-yl-4-piperidinyl)amino]-6-oxo-2-piperazinecarboxylic acid methyl ester IUPAC Name: methyl 4-(6-chloronaphthalen-2-yl)sulfonyl-1-[methyl-(1-pyridin-4-ylpiperidin-4-yl)amino]-6-oxopiperazine-2-carboxylate Traditional Name: 4-[(6-chloro-2-naphthyl)sulfonyl]-6-keto-1-[methyl-[1-(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:

CN(C1CCN(CC1)C2=CC=NC=C2)N3C(CN(CC3=O)S(=O)(=O)C4=CC5=C(C=C4)C=C(C=C5)Cl)C(=O)OC

Isomeric SMILES

CN(C1CCN(CC1)C2=CC=NC=C2)N3C(CN(CC3=O)S(=O)(=O)C4=CC5=C(C=C4)C=C(C=C5)Cl)C(=O)OC

InChI

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