2-[(5-azanyl-1H-1,2,4-triazol-3-yl)sulfanyl]-1-(2,6-dimethylpiperidin-1-yl)ethanone

Systemtic Name: 2-[(5-azanyl-1H-1,2,4-triazol-3-yl)sulfanyl]-1-(2,6-dimethylpiperidin-1-yl)ethanone Openeye Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]-1-(2,6-dimethyl-1-piperidyl)ethanone CAS Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)thio]-1-(2,6-dimethyl-1-piperidinyl)ethanone IUPAC Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]-1-(2,6-dimethylpiperidin-1-yl)ethanone Traditional Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)thio]-1-(2,6-dimethylpiperidino)ethanone Formula: C11H19N5OS MolecularWeight: 269.36646

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1C(=O)CSC2=NNC(=N2)N)C

Isomeric SMILES

CC1CCCC(N1C(=O)CSC2=NNC(=N2)N)C

InChI

InChI=1S/C11H19N5OS/c1-7-4-3-5-8(2)16(7)9(17)6-18-11-13-10(12)14-15-11/h7-8H,3-6H2,1-2H3,(H3,12,13,14,15)