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Nom: 4-{2-[3-(4-methyl-cyclohexyl)-3-piperidin-4-yl-ureido]-thiazol-5-ylmethyl}-piperazine-1-sulfonic acid dimethylamide hydrochloride

IUPAC: 3-[5-[[4-(dimethylsulfamoyl)piperazin-1-yl]methyl]-1,3-thiazol-2-yl]-1-(4-methylcyclohexyl)-1-piperidin-4-ylurea;hydrochloride

SMILES: CC1CCC(N(C(=O)Nc2ncc(CN3CCN(S(=O)(=O)N(C)C)CC3)s2)C2CCNCC2)CC1.Cl

Canonical SMILES: CC1CCC(CC1)N(C2CCNCC2)C(=O)NC3=NC=C(S3)CN4CCN(CC4)S(=O)(=O)N(C)C.Cl

Formule moléculaire: C23H42ClN7O3S2

Masse molaire: 564.20

InChIKey: IYTVSGNTZZJPSH-UHFFFAOYSA-N

InChI: InChI=1S/C23H41N7O3S2.ClH/c1-18-4-6-19(7-5-18)30(20-8-10-24-11-9-20)23(31)26-22-25-16-21(34-22)17-28-12-14-29(15-13-28)35(32,33)27(2)3;/h16,18-20,24H,4-15,17H2,1-3H3,(H,25,26,31);1H

PubChem CID: 86611205 →

Synonymes

SCHEMBL998665IYTVSGNTZZJPSH-UHFFFAOYSA-N4-{2-[3-(4-methyl-cyclohexyl)-3-piperidin-4-yl-ureido]-thiazol-5-ylmethyl}-piperazine-1-sulfonic acid dimethylamide hydrochloride

Recherche Etendue

Recherche de Sous-structure→Recherche de Similitude→