2-[3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(3-hydroxyphenyl)ethanamide

Systemtic Name: 2-[3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(3-hydroxyphenyl)ethanamide Openeye Name: 2-[3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-quinazolin-2-yl]sulfanyl-N-(3-hydroxyphenyl)acetamide CAS Name: 2-[[3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-2-quinazolinyl]thio]-N-(3-hydroxyphenyl)acetamide IUPAC Name: 2-[3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxoquinazolin-2-yl]sulfanyl-N-(3-hydroxyphenyl)acetamide Traditional Name: 2-[(3-homoveratryl-4-keto-quinazolin-2-yl)thio]-N-(3-hydroxyphenyl)acetamide Formula: C26H25N3O5S MolecularWeight: 491.5588

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCN2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC4=CC(=CC=C4)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCN2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC4=CC(=CC=C4)O)OC

InChI

InChI=1S/C26H25N3O5S/c1-33-22-11-10-17(14-23(22)34-2)12-13-29-25(32)20-8-3-4-9-21(20)28-26(29)35-16-24(31)27-18-6-5-7-19(30)15-18/h3-11,14-15,30H,12-13,16H2,1-2H3,(H,27,31)