4-[(2S)-pentan-2-yl]-5-propyl-1,2,4-triazole-3-thiolate

Systemtic Name: 4-[(2S)-pentan-2-yl]-5-propyl-1,2,4-triazole-3-thiolate Openeye Name: 4-[(1S)-1-methylbutyl]-5-propyl-1,2,4-triazole-3-thiolate CAS Name: 4-[(2S)-pentan-2-yl]-5-propyl-1,2,4-triazole-3-thiolate IUPAC Name: 4-[(2S)-pentan-2-yl]-5-propyl-1,2,4-triazole-3-thiolate Traditional Name: 4-[(1S)-1-methylbutyl]-5-propyl-1,2,4-triazole-3-thiolate Formula: C10H18N3S- MolecularWeight: 212.33502

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN=C(N1C(C)CCC)[S-]

Isomeric SMILES

CCCC1=NN=C(N1[C@@H](C)CCC)[S-]

InChI

InChI=1S/C10H19N3S/c1-4-6-8(3)13-9(7-5-2)11-12-10(13)14/h8H,4-7H2,1-3H3,(H,12,14)/p-1/t8-/m0/s1