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

Systemtic Name: 2-[3-(6-methoxyhepta-1,3,5-trien-3-yl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(4-phenoxyphenyl)ethanamide Openeye Name: 2-[3-(4-methoxy-1-vinyl-penta-1,3-dienyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-(4-phenoxyphenyl)acetamide CAS Name: 2-[[3-(6-methoxyhepta-1,3,5-trien-3-yl)-4-oxo-2-quinazolinyl]thio]-N-(4-phenoxyphenyl)acetamide IUPAC Name: 2-[3-(6-methoxyhepta-1,3,5-trien-3-yl)-4-oxoquinazolin-2-yl]sulfanyl-N-(4-phenoxyphenyl)acetamide Traditional Name: 2-[[4-keto-3-(4-methoxy-1-vinyl-penta-1,3-dienyl)quinazolin-2-yl]thio]-N-(4-phenoxyphenyl)acetamide Formula: C30H27N3O4S MolecularWeight: 525.61808

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC=C(C=C)N1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC3=CC=C(C=C3)OC4=CC=CC=C4)OC

Isomeric SMILES

CC(=CC=C(C=C)N1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC3=CC=C(C=C3)OC4=CC=CC=C4)OC

InChI

InChI=1S/C30H27N3O4S/c1-4-23(17-14-21(2)36-3)33-29(35)26-12-8-9-13-27(26)32-30(33)38-20-28(34)31-22-15-18-25(19-16-22)37-24-10-6-5-7-11-24/h4-19H,1,20H2,2-3H3,(H,31,34)