3-azanyl-6-(1H-imidazol-2-ylsulfanyl)-1-(4-methylpiperidin-1-yl)hexane-1,2-dione

Systemtic Name: 3-azanyl-6-(1H-imidazol-2-ylsulfanyl)-1-(4-methylpiperidin-1-yl)hexane-1,2-dione Openeye Name: 3-amino-6-(1H-imidazol-2-ylsulfanyl)-1-(4-methyl-1-piperidyl)hexane-1,2-dione CAS Name: 3-amino-6-(1H-imidazol-2-ylthio)-1-(4-methyl-1-piperidinyl)hexane-1,2-dione IUPAC Name: 3-amino-6-(1H-imidazol-2-ylsulfanyl)-1-(4-methylpiperidin-1-yl)hexane-1,2-dione Traditional Name: 3-amino-6-(1H-imidazol-2-ylthio)-1-(4-methylpiperidino)hexane-1,2-dione Formula: C15H24N4O2S MolecularWeight: 324.44166

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=O)C(=O)C(CCCSC2=NC=CN2)N

Isomeric SMILES

CC1CCN(CC1)C(=O)C(=O)C(CCCSC2=NC=CN2)N

InChI

InChI=1S/C15H24N4O2S/c1-11-4-8-19(9-5-11)14(21)13(20)12(16)3-2-10-22-15-17-6-7-18-15/h6-7,11-12H,2-5,8-10,16H2,1H3,(H,17,18)