1-[[4-(6-chloranylnaphthalen-2-yl)sulfonyl-1-pyridin-4-yl-piperidin-4-yl]methyl]piperazin-2-one; methanesulfonic acid

Systemtic Name: 1-[[4-(6-chloranylnaphthalen-2-yl)sulfonyl-1-pyridin-4-yl-piperidin-4-yl]methyl]piperazin-2-one; methanesulfonic acid Openeye Name: 1-[[4-[(6-chloro-2-naphthyl)sulfonyl]-1-(4-pyridyl)-4-piperidyl]methyl]piperazin-2-one; methanesulfonic acid CAS Name: 1-[[4-[(6-chloro-2-naphthalenyl)sulfonyl]-1-pyridin-4-yl-4-piperidinyl]methyl]-2-piperazinone; methanesulfonic acid IUPAC Name: 1-[[4-(6-chloronaphthalen-2-yl)sulfonyl-1-pyridin-4-ylpiperidin-4-yl]methyl]piperazin-2-one; methanesulfonic acid Traditional Name: 1-[[4-[(6-chloro-2-naphthyl)sulfonyl]-1-(4-pyridyl)-4-piperidyl]methyl]piperazin-2-one; mesylic acid Formula: C26H31ClN4O6S2 MolecularWeight: 595.13054

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)O.C1CN(CCC1(CN2CCNCC2=O)S(=O)(=O)C3=CC4=C(C=C3)C=C(C=C4)Cl)C5=CC=NC=C5

Isomeric SMILES

CS(=O)(=O)O.C1CN(CCC1(CN2CCNCC2=O)S(=O)(=O)C3=CC4=C(C=C3)C=C(C=C4)Cl)C5=CC=NC=C5

InChI

InChI=1S/C25H27ClN4O3S.CH4O3S/c26-21-3-1-20-16-23(4-2-19(20)15-21)34(32,33)25(18-30-14-11-28-17-24(30)31)7-12-29(13-8-25)22-5-9-27-10-6-22;1-5(2,3)4/h1-6,9-10,15-16,28H,7-8,11-14,17-18H2;1H3,(H,2,3,4)