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

Systemtic Name: 4-(6-chloranylnaphthalen-2-yl)sulfonyl-1-[pyridin-4-yl(pyrrolidin-3-yl)methyl]piperazin-2-one hydrochloride Openeye Name: 4-[(6-chloro-2-naphthyl)sulfonyl]-1-[4-pyridyl(pyrrolidin-3-yl)methyl]piperazin-2-one hydrochloride CAS Name: 4-[(6-chloro-2-naphthalenyl)sulfonyl]-1-[pyridin-4-yl(3-pyrrolidinyl)methyl]-2-piperazinone hydrochloride IUPAC Name: 4-(6-chloronaphthalen-2-yl)sulfonyl-1-[pyridin-4-yl(pyrrolidin-3-yl)methyl]piperazin-2-one hydrochloride Traditional Name: 4-[(6-chloro-2-naphthyl)sulfonyl]-1-[4-pyridyl(pyrrolidin-3-yl)methyl]piperazin-2-one hydrochloride Formula: C24H26Cl2N4O3S MolecularWeight: 521.45924

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCC1C(C2=CC=NC=C2)N3CCN(CC3=O)S(=O)(=O)C4=CC5=C(C=C4)C=C(C=C5)Cl.Cl

Isomeric SMILES

C1CNCC1C(C2=CC=NC=C2)N3CCN(CC3=O)S(=O)(=O)C4=CC5=C(C=C4)C=C(C=C5)Cl.Cl

InChI

InChI=1S/C24H25ClN4O3S.ClH/c25-21-3-1-19-14-22(4-2-18(19)13-21)33(31,32)28-11-12-29(23(30)16-28)24(20-7-10-27-15-20)17-5-8-26-9-6-17;/h1-6,8-9,13-14,20,24,27H,7,10-12,15-16H2;1H