4-(6-chloranylnaphthalen-2-yl)sulfonyl-1-[piperidin-3-yl(pyridin-4-yl)methyl]piperazin-2-one hydrochloride

Systemtic Name: 4-(6-chloranylnaphthalen-2-yl)sulfonyl-1-[piperidin-3-yl(pyridin-4-yl)methyl]piperazin-2-one hydrochloride Openeye Name: 4-[(6-chloro-2-naphthyl)sulfonyl]-1-[3-piperidyl(4-pyridyl)methyl]piperazin-2-one hydrochloride CAS Name: 4-[(6-chloro-2-naphthalenyl)sulfonyl]-1-[3-piperidinyl(pyridin-4-yl)methyl]-2-piperazinone hydrochloride IUPAC Name: 4-(6-chloronaphthalen-2-yl)sulfonyl-1-[piperidin-3-yl(pyridin-4-yl)methyl]piperazin-2-one hydrochloride Traditional Name: 4-[(6-chloro-2-naphthyl)sulfonyl]-1-[3-piperidyl(4-pyridyl)methyl]piperazin-2-one hydrochloride Formula: C25H28Cl2N4O3S MolecularWeight: 535.48582

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CNC1)C(C2=CC=NC=C2)N3CCN(CC3=O)S(=O)(=O)C4=CC5=C(C=C4)C=C(C=C5)Cl.Cl

Isomeric SMILES

C1CC(CNC1)C(C2=CC=NC=C2)N3CCN(CC3=O)S(=O)(=O)C4=CC5=C(C=C4)C=C(C=C5)Cl.Cl

InChI

InChI=1S/C25H27ClN4O3S.ClH/c26-22-5-3-20-15-23(6-4-19(20)14-22)34(32,33)29-12-13-30(24(31)17-29)25(18-7-10-27-11-8-18)21-2-1-9-28-16-21;/h3-8,10-11,14-15,21,25,28H,1-2,9,12-13,16-17H2;1H