4-[[2-[3-(4-ethoxyphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoylhydrazinylidene]methyl]benzoic acid

Systemtic Name: 4-[[2-[3-(4-ethoxyphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoylhydrazinylidene]methyl]benzoic acid Openeye Name: 4-[[[2-[3-(4-ethoxyphenyl)-4-oxo-quinazolin-2-yl]sulfanylacetyl]hydrazono]methyl]benzoic acid CAS Name: 4-[[[2-[[3-(4-ethoxyphenyl)-4-oxo-2-quinazolinyl]thio]-1-oxoethyl]hydrazinylidene]methyl]benzoic acid IUPAC Name: 4-[[[2-[3-(4-ethoxyphenyl)-4-oxoquinazolin-2-yl]sulfanylacetyl]hydrazinylidene]methyl]benzoic acid Traditional Name: 4-[[[2-[(4-keto-3-p-phenetyl-quinazolin-2-yl)thio]acetyl]hydrazono]methyl]benzoic acid Formula: C26H22N4O5S MolecularWeight: 502.54168

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NN=CC4=CC=C(C=C4)C(=O)O

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NN=CC4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C26H22N4O5S/c1-2-35-20-13-11-19(12-14-20)30-24(32)21-5-3-4-6-22(21)28-26(30)36-16-23(31)29-27-15-17-7-9-18(10-8-17)25(33)34/h3-15H,2,16H2,1H3,(H,29,31)(H,33,34)