N-(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)-2-[3-(3-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]ethanamide

Systemtic Name: N-(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)-2-[3-(3-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]ethanamide Openeye Name: N-(5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl)-2-[3-(m-tolyl)-5-thioxo-1H-1,2,4-triazol-4-yl]acetamide CAS Name: N-(5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl)-2-[3-(3-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]acetamide IUPAC Name: N-(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)-2-[3-(3-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]acetamide Traditional Name: N-(5-ethoxy-2-methyl-coumaran-6-yl)-2-[3-(m-tolyl)-5-thioxo-1H-1,2,4-triazol-4-yl]acetamide Formula: C22H24N4O3S MolecularWeight: 424.51596

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)CC(O2)C)NC(=O)CN3C(=NNC3=S)C4=CC(=CC=C4)C

Isomeric SMILES

CCOC1=C(C=C2C(=C1)CC(O2)C)NC(=O)CN3C(=NNC3=S)C4=CC(=CC=C4)C

InChI

InChI=1S/C22H24N4O3S/c1-4-28-19-10-16-9-14(3)29-18(16)11-17(19)23-20(27)12-26-21(24-25-22(26)30)15-7-5-6-13(2)8-15/h5-8,10-11,14H,4,9,12H2,1-3H3,(H,23,27)(H,25,30)