5-(2-chlorophenyl)-4-(3-methoxypropyl)-1,2,4-triazole-3-thiolate

Systemtic Name: 5-(2-chlorophenyl)-4-(3-methoxypropyl)-1,2,4-triazole-3-thiolate Openeye Name: 5-(2-chlorophenyl)-4-(3-methoxypropyl)-1,2,4-triazole-3-thiolate CAS Name: 5-(2-chlorophenyl)-4-(3-methoxypropyl)-1,2,4-triazole-3-thiolate IUPAC Name: 5-(2-chlorophenyl)-4-(3-methoxypropyl)-1,2,4-triazole-3-thiolate Traditional Name: 5-(2-chlorophenyl)-4-(3-methoxypropyl)-1,2,4-triazole-3-thiolate Formula: C12H13ClN3OS- MolecularWeight: 282.76912

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN1C(=NN=C1[S-])C2=CC=CC=C2Cl

Isomeric SMILES

COCCCN1C(=NN=C1[S-])C2=CC=CC=C2Cl

InChI

InChI=1S/C12H14ClN3OS/c1-17-8-4-7-16-11(14-15-12(16)18)9-5-2-3-6-10(9)13/h2-3,5-6H,4,7-8H2,1H3,(H,15,18)/p-1