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

Systemtic Name: 2-[(4-azanyl-5-cyclohexyl-1,2,4-triazol-3-yl)sulfanyl]-1-(3,5-dimethylpiperidin-1-yl)ethanone Openeye Name: 2-[(4-amino-5-cyclohexyl-1,2,4-triazol-3-yl)sulfanyl]-1-(3,5-dimethyl-1-piperidyl)ethanone CAS Name: 2-[(4-amino-5-cyclohexyl-1,2,4-triazol-3-yl)thio]-1-(3,5-dimethyl-1-piperidinyl)ethanone IUPAC Name: 2-[(4-amino-5-cyclohexyl-1,2,4-triazol-3-yl)sulfanyl]-1-(3,5-dimethylpiperidin-1-yl)ethanone Traditional Name: 2-[(4-amino-5-cyclohexyl-1,2,4-triazol-3-yl)thio]-1-(3,5-dimethylpiperidino)ethanone Formula: C17H29N5OS MolecularWeight: 351.51006

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C(=O)CSC2=NN=C(N2N)C3CCCCC3)C

Isomeric SMILES

CC1CC(CN(C1)C(=O)CSC2=NN=C(N2N)C3CCCCC3)C

InChI

InChI=1S/C17H29N5OS/c1-12-8-13(2)10-21(9-12)15(23)11-24-17-20-19-16(22(17)18)14-6-4-3-5-7-14/h12-14H,3-11,18H2,1-2H3