4-(4-propan-2-yloxyphenyl)-5-propyl-1,2,4-triazole-3-thiolate

Systemtic Name: 4-(4-propan-2-yloxyphenyl)-5-propyl-1,2,4-triazole-3-thiolate Openeye Name: 4-(4-isopropoxyphenyl)-5-propyl-1,2,4-triazole-3-thiolate CAS Name: 4-(4-propan-2-yloxyphenyl)-5-propyl-1,2,4-triazole-3-thiolate IUPAC Name: 4-(4-propan-2-yloxyphenyl)-5-propyl-1,2,4-triazole-3-thiolate Traditional Name: 4-(4-isopropoxyphenyl)-5-propyl-1,2,4-triazole-3-thiolate Formula: C14H18N3OS- MolecularWeight: 276.37722

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN=C(N1C2=CC=C(C=C2)OC(C)C)[S-]

Isomeric SMILES

CCCC1=NN=C(N1C2=CC=C(C=C2)OC(C)C)[S-]

InChI

InChI=1S/C14H19N3OS/c1-4-5-13-15-16-14(19)17(13)11-6-8-12(9-7-11)18-10(2)3/h6-10H,4-5H2,1-3H3,(H,16,19)/p-1