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

Systemtic Name: N-[(4-ethoxyphenyl)methyl]-N-methyl-2-[3-(3-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]ethanamide Openeye Name: N-[(4-ethoxyphenyl)methyl]-N-methyl-2-[3-(m-tolyl)-5-thioxo-1H-1,2,4-triazol-4-yl]acetamide CAS Name: N-[(4-ethoxyphenyl)methyl]-N-methyl-2-[3-(3-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]acetamide IUPAC Name: N-[(4-ethoxyphenyl)methyl]-N-methyl-2-[3-(3-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]acetamide Traditional Name: N-(4-ethoxybenzyl)-N-methyl-2-[3-(m-tolyl)-5-thioxo-1H-1,2,4-triazol-4-yl]acetamide Formula: C21H24N4O2S MolecularWeight: 396.50586

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CN(C)C(=O)CN2C(=NNC2=S)C3=CC(=CC=C3)C

Isomeric SMILES

CCOC1=CC=C(C=C1)CN(C)C(=O)CN2C(=NNC2=S)C3=CC(=CC=C3)C

InChI

InChI=1S/C21H24N4O2S/c1-4-27-18-10-8-16(9-11-18)13-24(3)19(26)14-25-20(22-23-21(25)28)17-7-5-6-15(2)12-17/h5-12H,4,13-14H2,1-3H3,(H,23,28)