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

Systemtic Name: 2-[6,7-dimethoxy-3-[(4-methoxyphenyl)methyl]-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(4-methylphenyl)butanamide Openeye Name: 2-[6,7-dimethoxy-3-[(4-methoxyphenyl)methyl]-4-oxo-quinazolin-2-yl]sulfanyl-N-(p-tolyl)butanamide CAS Name: 2-[[6,7-dimethoxy-3-[(4-methoxyphenyl)methyl]-4-oxo-2-quinazolinyl]thio]-N-(4-methylphenyl)butanamide IUPAC Name: 2-[6,7-dimethoxy-3-[(4-methoxyphenyl)methyl]-4-oxoquinazolin-2-yl]sulfanyl-N-(4-methylphenyl)butanamide Traditional Name: 2-[(4-keto-6,7-dimethoxy-3-p-anisyl-quinazolin-2-yl)thio]-N-(p-tolyl)butyramide Formula: C29H31N3O5S MolecularWeight: 533.63854

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)C)SC2=NC3=CC(=C(C=C3C(=O)N2CC4=CC=C(C=C4)OC)OC)OC

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)C)SC2=NC3=CC(=C(C=C3C(=O)N2CC4=CC=C(C=C4)OC)OC)OC

InChI

InChI=1S/C29H31N3O5S/c1-6-26(27(33)30-20-11-7-18(2)8-12-20)38-29-31-23-16-25(37-5)24(36-4)15-22(23)28(34)32(29)17-19-9-13-21(35-3)14-10-19/h7-16,26H,6,17H2,1-5H3,(H,30,33)