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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NN=CC4=CC=CC=C4C(=O)O

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NN=CC4=CC=CC=C4C(=O)O

InChI

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