5-(4-methoxyphenyl)-4-[2-(3-methoxypropylamino)-2-oxidanylidene-ethyl]-1,2,4-triazole-3-thiolate

Systemtic Name: 5-(4-methoxyphenyl)-4-[2-(3-methoxypropylamino)-2-oxidanylidene-ethyl]-1,2,4-triazole-3-thiolate Openeye Name: 5-(4-methoxyphenyl)-4-[2-(3-methoxypropylamino)-2-oxo-ethyl]-1,2,4-triazole-3-thiolate CAS Name: 5-(4-methoxyphenyl)-4-[2-(3-methoxypropylamino)-2-oxoethyl]-1,2,4-triazole-3-thiolate IUPAC Name: 5-(4-methoxyphenyl)-4-[2-(3-methoxypropylamino)-2-oxoethyl]-1,2,4-triazole-3-thiolate Traditional Name: 4-[2-keto-2-(3-methoxypropylamino)ethyl]-5-(4-methoxyphenyl)-1,2,4-triazole-3-thiolate Formula: C15H19N4O3S- MolecularWeight: 335.40136

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCCCNC(=O)CN1C(=NN=C1[S-])C2=CC=C(C=C2)OC

Isomeric SMILES

COCCCNC(=O)CN1C(=NN=C1[S-])C2=CC=C(C=C2)OC

InChI

InChI=1S/C15H20N4O3S/c1-21-9-3-8-16-13(20)10-19-14(17-18-15(19)23)11-4-6-12(22-2)7-5-11/h4-7H,3,8-10H2,1-2H3,(H,16,20)(H,18,23)/p-1