2-[3-azanyl-5-(2-oxidanylidene-2-piperidin-1-yl-ethyl)sulfanyl-1,2,4-triazol-4-yl]-1-piperidin-1-yl-ethanone

Systemtic Name: 2-[3-azanyl-5-(2-oxidanylidene-2-piperidin-1-yl-ethyl)sulfanyl-1,2,4-triazol-4-yl]-1-piperidin-1-yl-ethanone Openeye Name: 2-[3-amino-5-[2-oxo-2-(1-piperidyl)ethyl]sulfanyl-1,2,4-triazol-4-yl]-1-(1-piperidyl)ethanone CAS Name: 2-[3-amino-5-[[2-oxo-2-(1-piperidinyl)ethyl]thio]-1,2,4-triazol-4-yl]-1-(1-piperidinyl)ethanone IUPAC Name: 2-[3-amino-5-(2-oxo-2-piperidin-1-ylethyl)sulfanyl-1,2,4-triazol-4-yl]-1-piperidin-1-ylethanone Traditional Name: 2-[3-amino-5-[(2-keto-2-piperidino-ethyl)thio]-1,2,4-triazol-4-yl]-1-piperidino-ethanone Formula: C16H26N6O2S MolecularWeight: 366.48164

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)CN2C(=NN=C2SCC(=O)N3CCCCC3)N

Isomeric SMILES

C1CCN(CC1)C(=O)CN2C(=NN=C2SCC(=O)N3CCCCC3)N

InChI

InChI=1S/C16H26N6O2S/c17-15-18-19-16(25-12-14(24)21-9-5-2-6-10-21)22(15)11-13(23)20-7-3-1-4-8-20/h1-12H2,(H2,17,18)