4-(6-chloranylnaphthalen-2-yl)sulfonyl-1-[(1-ethanimidoylpiperidin-4-yl)-methyl-amino]piperazin-2-one hydrochloride

Systemtic Name: 4-(6-chloranylnaphthalen-2-yl)sulfonyl-1-[(1-ethanimidoylpiperidin-4-yl)-methyl-amino]piperazin-2-one hydrochloride Openeye Name: 4-[(6-chloro-2-naphthyl)sulfonyl]-1-[(1-ethanimidoyl-4-piperidyl)-methyl-amino]piperazin-2-one hydrochloride CAS Name: 4-[(6-chloro-2-naphthalenyl)sulfonyl]-1-[[1-(1-iminoethyl)-4-piperidinyl]-methylamino]-2-piperazinone hydrochloride IUPAC Name: 4-(6-chloronaphthalen-2-yl)sulfonyl-1-[(1-ethanimidoylpiperidin-4-yl)-methylamino]piperazin-2-one hydrochloride Traditional Name: 1-[(1-acetimidoyl-4-piperidyl)-methyl-amino]-4-[(6-chloro-2-naphthyl)sulfonyl]piperazin-2-one hydrochloride Formula: C22H29Cl2N5O3S MolecularWeight: 514.46836

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Descriptors Computed from Structure

Canonical SMILES:

CC(=N)N1CCC(CC1)N(C)N2CCN(CC2=O)S(=O)(=O)C3=CC4=C(C=C3)C=C(C=C4)Cl.Cl

Isomeric SMILES

CC(=N)N1CCC(CC1)N(C)N2CCN(CC2=O)S(=O)(=O)C3=CC4=C(C=C3)C=C(C=C4)Cl.Cl

InChI

InChI=1S/C22H28ClN5O3S.ClH/c1-16(24)26-9-7-20(8-10-26)25(2)28-12-11-27(15-22(28)29)32(30,31)21-6-4-17-13-19(23)5-3-18(17)14-21;/h3-6,13-14,20,24H,7-12,15H2,1-2H3;1H