N-(2-ethoxyphenyl)-2-[3-(6-methoxyhepta-1,3,5-trien-3-yl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(2-ethoxyphenyl)-2-[3-(6-methoxyhepta-1,3,5-trien-3-yl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide Openeye Name: N-(2-ethoxyphenyl)-2-[3-(4-methoxy-1-vinyl-penta-1,3-dienyl)-4-oxo-quinazolin-2-yl]sulfanyl-acetamide CAS Name: N-(2-ethoxyphenyl)-2-[[3-(6-methoxyhepta-1,3,5-trien-3-yl)-4-oxo-2-quinazolinyl]thio]acetamide IUPAC Name: N-(2-ethoxyphenyl)-2-[3-(6-methoxyhepta-1,3,5-trien-3-yl)-4-oxoquinazolin-2-yl]sulfanylacetamide Traditional Name: 2-[[4-keto-3-(4-methoxy-1-vinyl-penta-1,3-dienyl)quinazolin-2-yl]thio]-N-o-phenetyl-acetamide Formula: C26H27N3O4S MolecularWeight: 477.57528

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2C(=CC=C(C)OC)C=C

Isomeric SMILES

CCOC1=CC=CC=C1NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2C(=CC=C(C)OC)C=C

InChI

InChI=1S/C26H27N3O4S/c1-5-19(16-15-18(3)32-4)29-25(31)20-11-7-8-12-21(20)28-26(29)34-17-24(30)27-22-13-9-10-14-23(22)33-6-2/h5,7-16H,1,6,17H2,2-4H3,(H,27,30)