2-[3-(4-ethoxyphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-[(4-propoxyphenyl)methylideneamino]ethanamide

Systemtic Name: 2-[3-(4-ethoxyphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-[(4-propoxyphenyl)methylideneamino]ethanamide Openeye Name: 2-[3-(4-ethoxyphenyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-[(4-propoxyphenyl)methyleneamino]acetamide CAS Name: 2-[[3-(4-ethoxyphenyl)-4-oxo-2-quinazolinyl]thio]-N-[(4-propoxyphenyl)methylideneamino]acetamide IUPAC Name: 2-[3-(4-ethoxyphenyl)-4-oxoquinazolin-2-yl]sulfanyl-N-[(4-propoxyphenyl)methylideneamino]acetamide Traditional Name: 2-[(4-keto-3-p-phenetyl-quinazolin-2-yl)thio]-N-[(4-propoxybenzylidene)amino]acetamide Formula: C28H28N4O4S MolecularWeight: 516.61132

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C=NNC(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC=C(C=C4)OCC

Isomeric SMILES

CCCOC1=CC=C(C=C1)C=NNC(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC=C(C=C4)OCC

InChI

InChI=1S/C28H28N4O4S/c1-3-17-36-23-13-9-20(10-14-23)18-29-31-26(33)19-37-28-30-25-8-6-5-7-24(25)27(34)32(28)21-11-15-22(16-12-21)35-4-2/h5-16,18H,3-4,17,19H2,1-2H3,(H,31,33)