2-[3-(4-methoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-methyl-N-(3-phenoxypropyl)ethanamide

Systemtic Name: 2-[3-(4-methoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-methyl-N-(3-phenoxypropyl)ethanamide Openeye Name: 2-[3-(4-methoxyphenyl)-5-thioxo-1H-1,2,4-triazol-4-yl]-N-methyl-N-(3-phenoxypropyl)acetamide CAS Name: 2-[3-(4-methoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-methyl-N-(3-phenoxypropyl)acetamide IUPAC Name: 2-[3-(4-methoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-methyl-N-(3-phenoxypropyl)acetamide Traditional Name: 2-[3-(4-methoxyphenyl)-5-thioxo-1H-1,2,4-triazol-4-yl]-N-methyl-N-(3-phenoxypropyl)acetamide Formula: C21H24N4O3S MolecularWeight: 412.50526

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCOC1=CC=CC=C1)C(=O)CN2C(=NNC2=S)C3=CC=C(C=C3)OC

Isomeric SMILES

CN(CCCOC1=CC=CC=C1)C(=O)CN2C(=NNC2=S)C3=CC=C(C=C3)OC

InChI

InChI=1S/C21H24N4O3S/c1-24(13-6-14-28-18-7-4-3-5-8-18)19(26)15-25-20(22-23-21(25)29)16-9-11-17(27-2)12-10-16/h3-5,7-12H,6,13-15H2,1-2H3,(H,23,29)