2-[(4-methyl-5-pyrazin-2-yl-1,2,4-triazol-3-yl)sulfanyl]-1-pyrrolidin-1-yl-ethanone

Systemtic Name: 2-[(4-methyl-5-pyrazin-2-yl-1,2,4-triazol-3-yl)sulfanyl]-1-pyrrolidin-1-yl-ethanone Openeye Name: 2-[(4-methyl-5-pyrazin-2-yl-1,2,4-triazol-3-yl)sulfanyl]-1-pyrrolidin-1-yl-ethanone CAS Name: 2-[[4-methyl-5-(2-pyrazinyl)-1,2,4-triazol-3-yl]thio]-1-(1-pyrrolidinyl)ethanone IUPAC Name: 2-[(4-methyl-5-pyrazin-2-yl-1,2,4-triazol-3-yl)sulfanyl]-1-pyrrolidin-1-ylethanone Traditional Name: 2-[(4-methyl-5-pyrazin-2-yl-1,2,4-triazol-3-yl)thio]-1-pyrrolidino-ethanone Formula: C13H16N6OS MolecularWeight: 304.37074

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC(=O)N2CCCC2)C3=NC=CN=C3

Isomeric SMILES

CN1C(=NN=C1SCC(=O)N2CCCC2)C3=NC=CN=C3

InChI

InChI=1S/C13H16N6OS/c1-18-12(10-8-14-4-5-15-10)16-17-13(18)21-9-11(20)19-6-2-3-7-19/h4-5,8H,2-3,6-7,9H2,1H3