4-[(2S)-butan-2-yl]-3-[2-(3-methylpyrazol-1-yl)ethyl]-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-[(2S)-butan-2-yl]-3-[2-(3-methylpyrazol-1-yl)ethyl]-1H-1,2,4-triazole-5-thione Openeye Name: 4-[(1S)-1-methylpropyl]-3-[2-(3-methylpyrazol-1-yl)ethyl]-1H-1,2,4-triazole-5-thione CAS Name: 4-[(2S)-butan-2-yl]-3-[2-(3-methyl-1-pyrazolyl)ethyl]-1H-1,2,4-triazole-5-thione IUPAC Name: 4-[(2S)-butan-2-yl]-3-[2-(3-methylpyrazol-1-yl)ethyl]-1H-1,2,4-triazole-5-thione Traditional Name: 4-[(1S)-1-methylpropyl]-3-[2-(3-methylpyrazol-1-yl)ethyl]-1H-1,2,4-triazole-5-thione Formula: C12H19N5S MolecularWeight: 265.37776

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C(=NNC1=S)CCN2C=CC(=N2)C

Isomeric SMILES

CC[C@H](C)N1C(=NNC1=S)CCN2C=CC(=N2)C

InChI

InChI=1S/C12H19N5S/c1-4-10(3)17-11(13-14-12(17)18)6-8-16-7-5-9(2)15-16/h5,7,10H,4,6,8H2,1-3H3,(H,14,18)/t10-/m0/s1