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

Systemtic Name: N-(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)-3-[3-(4-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]propanamide Openeye Name: N-(5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl)-3-[3-(p-tolyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propanamide CAS Name: N-(5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl)-3-[3-(4-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]propanamide IUPAC Name: N-(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)-3-[3-(4-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]propanamide Traditional Name: N-(5-ethoxy-2-methyl-coumaran-6-yl)-3-[3-(p-tolyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propionamide Formula: C23H26N4O3S MolecularWeight: 438.54254

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)CC(O2)C)NC(=O)CCN3C(=NNC3=S)C4=CC=C(C=C4)C

Isomeric SMILES

CCOC1=C(C=C2C(=C1)CC(O2)C)NC(=O)CCN3C(=NNC3=S)C4=CC=C(C=C4)C

InChI

InChI=1S/C23H26N4O3S/c1-4-29-20-12-17-11-15(3)30-19(17)13-18(20)24-21(28)9-10-27-22(25-26-23(27)31)16-7-5-14(2)6-8-16/h5-8,12-13,15H,4,9-11H2,1-3H3,(H,24,28)(H,26,31)