1-[4-(6-chloranylnaphthalen-2-yl)sulfonylpiperazin-1-yl]-2-pyridin-4-yl-ethanone hydrochloride

Systemtic Name: 1-[4-(6-chloranylnaphthalen-2-yl)sulfonylpiperazin-1-yl]-2-pyridin-4-yl-ethanone hydrochloride Openeye Name: 1-[4-[(6-chloro-2-naphthyl)sulfonyl]piperazin-1-yl]-2-(4-pyridyl)ethanone hydrochloride CAS Name: 1-[4-[(6-chloro-2-naphthalenyl)sulfonyl]-1-piperazinyl]-2-pyridin-4-ylethanone hydrochloride IUPAC Name: 1-[4-(6-chloronaphthalen-2-yl)sulfonylpiperazin-1-yl]-2-pyridin-4-ylethanone hydrochloride Traditional Name: 1-[4-[(6-chloro-2-naphthyl)sulfonyl]piperazino]-2-(4-pyridyl)ethanone hydrochloride Formula: C21H21Cl2N3O3S MolecularWeight: 466.38074

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CC2=CC=NC=C2)S(=O)(=O)C3=CC4=C(C=C3)C=C(C=C4)Cl.Cl

Isomeric SMILES

C1CN(CCN1C(=O)CC2=CC=NC=C2)S(=O)(=O)C3=CC4=C(C=C3)C=C(C=C4)Cl.Cl

InChI

InChI=1S/C21H20ClN3O3S.ClH/c22-19-3-1-18-15-20(4-2-17(18)14-19)29(27,28)25-11-9-24(10-12-25)21(26)13-16-5-7-23-8-6-16;/h1-8,14-15H,9-13H2;1H