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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCC(C(=O)NC1=CC=CC(=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)30-20-9-7-8-18(2)14-20)38-29-31-23-16-25(37-5)24(36-4)15-22(23)28(34)32(29)17-19-10-12-21(35-3)13-11-19/h7-16,26H,6,17H2,1-5H3,(H,30,33)