azanyl 3-(6-chloranylnaphthalen-2-yl)sulfonyl-1-methyl-6-oxidanylidene-2-(1-pyridin-4-ylpiperidin-4-yl)piperazine-2-carboxylate hydrochloride

Systemtic Name: azanyl 3-(6-chloranylnaphthalen-2-yl)sulfonyl-1-methyl-6-oxidanylidene-2-(1-pyridin-4-ylpiperidin-4-yl)piperazine-2-carboxylate hydrochloride Openeye Name: amino 3-[(6-chloro-2-naphthyl)sulfonyl]-1-methyl-6-oxo-2-[1-(4-pyridyl)-4-piperidyl]piperazine-2-carboxylate hydrochloride CAS Name: 3-[(6-chloro-2-naphthalenyl)sulfonyl]-1-methyl-6-oxo-2-(1-pyridin-4-yl-4-piperidinyl)-2-piperazinecarboxylic acid amino ester hydrochloride IUPAC Name: amino 3-(6-chloronaphthalen-2-yl)sulfonyl-1-methyl-6-oxo-2-(1-pyridin-4-ylpiperidin-4-yl)piperazine-2-carboxylate hydrochloride Traditional Name: 3-[(6-chloro-2-naphthyl)sulfonyl]-6-keto-1-methyl-2-[1-(4-pyridyl)-4-piperidyl]piperazine-2-carboxylic acid amino ester hydrochloride Formula: C26H29Cl2N5O5S MolecularWeight: 594.50996

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)CNC(C1(C2CCN(CC2)C3=CC=NC=C3)C(=O)ON)S(=O)(=O)C4=CC5=C(C=C4)C=C(C=C5)Cl.Cl

Isomeric SMILES

CN1C(=O)CNC(C1(C2CCN(CC2)C3=CC=NC=C3)C(=O)ON)S(=O)(=O)C4=CC5=C(C=C4)C=C(C=C5)Cl.Cl

InChI

InChI=1S/C26H28ClN5O5S.ClH/c1-31-23(33)16-30-24(38(35,36)22-5-3-17-14-20(27)4-2-18(17)15-22)26(31,25(34)37-28)19-8-12-32(13-9-19)21-6-10-29-11-7-21;/h2-7,10-11,14-15,19,24,30H,8-9,12-13,16,28H2,1H3;1H