4-(6-bromanylnaphthalen-2-yl)sulfonyl-1-[methyl-(1-pyridin-4-ylpiperidin-4-yl)amino]piperazin-2-one hydrochloride

Systemtic Name: 4-(6-bromanylnaphthalen-2-yl)sulfonyl-1-[methyl-(1-pyridin-4-ylpiperidin-4-yl)amino]piperazin-2-one hydrochloride Openeye Name: 4-[(6-bromo-2-naphthyl)sulfonyl]-1-[methyl-[1-(4-pyridyl)-4-piperidyl]amino]piperazin-2-one hydrochloride CAS Name: 4-[(6-bromo-2-naphthalenyl)sulfonyl]-1-[methyl-(1-pyridin-4-yl-4-piperidinyl)amino]-2-piperazinone hydrochloride IUPAC Name: 4-(6-bromonaphthalen-2-yl)sulfonyl-1-[methyl-(1-pyridin-4-ylpiperidin-4-yl)amino]piperazin-2-one hydrochloride Traditional Name: 4-[(6-bromo-2-naphthyl)sulfonyl]-1-[methyl-[1-(4-pyridyl)-4-piperidyl]amino]piperazin-2-one hydrochloride Formula: C25H29BrClN5O3S MolecularWeight: 594.95146

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCN(CC1)C2=CC=NC=C2)N3CCN(CC3=O)S(=O)(=O)C4=CC5=C(C=C4)C=C(C=C5)Br.Cl

Isomeric SMILES

CN(C1CCN(CC1)C2=CC=NC=C2)N3CCN(CC3=O)S(=O)(=O)C4=CC5=C(C=C4)C=C(C=C5)Br.Cl

InChI

InChI=1S/C25H28BrN5O3S.ClH/c1-28(22-8-12-29(13-9-22)23-6-10-27-11-7-23)31-15-14-30(18-25(31)32)35(33,34)24-5-3-19-16-21(26)4-2-20(19)17-24;/h2-7,10-11,16-17,22H,8-9,12-15,18H2,1H3;1H