1-[(4-azanylpiperidin-4-yl)-pyridin-4-yl-methyl]-4-(6-chloranylnaphthalen-2-yl)sulfonyl-piperazin-2-one dihydrochloride

Systemtic Name: 1-[(4-azanylpiperidin-4-yl)-pyridin-4-yl-methyl]-4-(6-chloranylnaphthalen-2-yl)sulfonyl-piperazin-2-one dihydrochloride Openeye Name: 1-[(4-amino-4-piperidyl)-(4-pyridyl)methyl]-4-[(6-chloro-2-naphthyl)sulfonyl]piperazin-2-one dihydrochloride CAS Name: 1-[(4-amino-4-piperidinyl)-pyridin-4-ylmethyl]-4-[(6-chloro-2-naphthalenyl)sulfonyl]-2-piperazinone dihydrochloride IUPAC Name: 1-[(4-aminopiperidin-4-yl)-pyridin-4-ylmethyl]-4-(6-chloronaphthalen-2-yl)sulfonylpiperazin-2-one dihydrochloride Traditional Name: 1-[(4-amino-4-piperidyl)-(4-pyridyl)methyl]-4-[(6-chloro-2-naphthyl)sulfonyl]piperazin-2-one dihydrochloride Formula: C25H30Cl3N5O3S MolecularWeight: 586.9614

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1(C(C2=CC=NC=C2)N3CCN(CC3=O)S(=O)(=O)C4=CC5=C(C=C4)C=C(C=C5)Cl)N.Cl.Cl

Isomeric SMILES

C1CNCCC1(C(C2=CC=NC=C2)N3CCN(CC3=O)S(=O)(=O)C4=CC5=C(C=C4)C=C(C=C5)Cl)N.Cl.Cl

InChI

InChI=1S/C25H28ClN5O3S.2ClH/c26-21-3-1-20-16-22(4-2-19(20)15-21)35(33,34)30-13-14-31(23(32)17-30)24(18-5-9-28-10-6-18)25(27)7-11-29-12-8-25;;/h1-6,9-10,15-16,24,29H,7-8,11-14,17,27H2;2*1H