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

Systemtic Name: 2-[(4-azanyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]-1-[(2S)-2-ethylpiperidin-1-yl]ethanone Openeye Name: 2-[[4-amino-5-(3-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]-1-[(2S)-2-ethyl-1-piperidyl]ethanone CAS Name: 2-[[4-amino-5-(3-pyridinyl)-1,2,4-triazol-3-yl]thio]-1-[(2S)-2-ethyl-1-piperidinyl]ethanone IUPAC Name: 2-[(4-amino-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]-1-[(2S)-2-ethylpiperidin-1-yl]ethanone Traditional Name: 2-[[4-amino-5-(3-pyridyl)-1,2,4-triazol-3-yl]thio]-1-[(2S)-2-ethylpiperidino]ethanone Formula: C16H22N6OS MolecularWeight: 346.45048

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1C(=O)CSC2=NN=C(N2N)C3=CN=CC=C3

Isomeric SMILES

CC[C@H]1CCCCN1C(=O)CSC2=NN=C(N2N)C3=CN=CC=C3

InChI

InChI=1S/C16H22N6OS/c1-2-13-7-3-4-9-21(13)14(23)11-24-16-20-19-15(22(16)17)12-6-5-8-18-10-12/h5-6,8,10,13H,2-4,7,9,11,17H2,1H3/t13-/m0/s1