4-[(1S,2R)-2-methylcyclohexyl]-5-propyl-1,2,4-triazole-3-thiolate

Systemtic Name: 4-[(1S,2R)-2-methylcyclohexyl]-5-propyl-1,2,4-triazole-3-thiolate Openeye Name: 4-[(1S,2R)-2-methylcyclohexyl]-5-propyl-1,2,4-triazole-3-thiolate CAS Name: 4-[(1S,2R)-2-methylcyclohexyl]-5-propyl-1,2,4-triazole-3-thiolate IUPAC Name: 4-[(1S,2R)-2-methylcyclohexyl]-5-propyl-1,2,4-triazole-3-thiolate Traditional Name: 4-[(1S,2R)-2-methylcyclohexyl]-5-propyl-1,2,4-triazole-3-thiolate Formula: C12H20N3S- MolecularWeight: 238.3723

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN=C(N1C2CCCCC2C)[S-]

Isomeric SMILES

CCCC1=NN=C(N1[C@H]2CCCC[C@H]2C)[S-]

InChI

InChI=1S/C12H21N3S/c1-3-6-11-13-14-12(16)15(11)10-8-5-4-7-9(10)2/h9-10H,3-8H2,1-2H3,(H,14,16)/p-1/t9-,10+/m1/s1