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

Systemtic Name: 2-[(4-azanyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-1-(4-methylpiperidin-1-yl)ethanone Openeye Name: 2-[[4-amino-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]-1-(4-methyl-1-piperidyl)ethanone CAS Name: 2-[(4-amino-5-pyridin-4-yl-1,2,4-triazol-3-yl)thio]-1-(4-methyl-1-piperidinyl)ethanone IUPAC Name: 2-[(4-amino-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-1-(4-methylpiperidin-1-yl)ethanone Traditional Name: 2-[[4-amino-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]-1-(4-methylpiperidino)ethanone Formula: C15H20N6OS MolecularWeight: 332.4239

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=O)CSC2=NN=C(N2N)C3=CC=NC=C3

Isomeric SMILES

CC1CCN(CC1)C(=O)CSC2=NN=C(N2N)C3=CC=NC=C3

InChI

InChI=1S/C15H20N6OS/c1-11-4-8-20(9-5-11)13(22)10-23-15-19-18-14(21(15)16)12-2-6-17-7-3-12/h2-3,6-7,11H,4-5,8-10,16H2,1H3