2-[6,7-dimethoxy-3-[(4-methoxyphenyl)methyl]-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-phenethyl-ethanamide

Systemtic Name: 2-[6,7-dimethoxy-3-[(4-methoxyphenyl)methyl]-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-phenethyl-ethanamide Openeye Name: 2-[6,7-dimethoxy-3-[(4-methoxyphenyl)methyl]-4-oxo-quinazolin-2-yl]sulfanyl-N-phenethyl-acetamide CAS Name: 2-[[6,7-dimethoxy-3-[(4-methoxyphenyl)methyl]-4-oxo-2-quinazolinyl]thio]-N-phenethylacetamide IUPAC Name: 2-[6,7-dimethoxy-3-[(4-methoxyphenyl)methyl]-4-oxoquinazolin-2-yl]sulfanyl-N-phenethylacetamide Traditional Name: 2-[(4-keto-6,7-dimethoxy-3-p-anisyl-quinazolin-2-yl)thio]-N-phenethyl-acetamide Formula: C28H29N3O5S MolecularWeight: 519.61196

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2C(=O)C3=CC(=C(C=C3N=C2SCC(=O)NCCC4=CC=CC=C4)OC)OC

Isomeric SMILES

COC1=CC=C(C=C1)CN2C(=O)C3=CC(=C(C=C3N=C2SCC(=O)NCCC4=CC=CC=C4)OC)OC

InChI

InChI=1S/C28H29N3O5S/c1-34-21-11-9-20(10-12-21)17-31-27(33)22-15-24(35-2)25(36-3)16-23(22)30-28(31)37-18-26(32)29-14-13-19-7-5-4-6-8-19/h4-12,15-16H,13-14,17-18H2,1-3H3,(H,29,32)