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

Systemtic Name: N-(4-chlorophenyl)-2-[6,7-dimethoxy-3-[(4-methoxyphenyl)methyl]-4-oxidanylidene-quinazolin-2-yl]sulfanyl-butanamide Openeye Name: N-(4-chlorophenyl)-2-[6,7-dimethoxy-3-[(4-methoxyphenyl)methyl]-4-oxo-quinazolin-2-yl]sulfanyl-butanamide CAS Name: N-(4-chlorophenyl)-2-[[6,7-dimethoxy-3-[(4-methoxyphenyl)methyl]-4-oxo-2-quinazolinyl]thio]butanamide IUPAC Name: N-(4-chlorophenyl)-2-[6,7-dimethoxy-3-[(4-methoxyphenyl)methyl]-4-oxoquinazolin-2-yl]sulfanylbutanamide Traditional Name: N-(4-chlorophenyl)-2-[(4-keto-6,7-dimethoxy-3-p-anisyl-quinazolin-2-yl)thio]butyramide Formula: C28H28ClN3O5S MolecularWeight: 554.05702

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C28H28ClN3O5S/c1-5-25(26(33)30-19-10-8-18(29)9-11-19)38-28-31-22-15-24(37-4)23(36-3)14-21(22)27(34)32(28)16-17-6-12-20(35-2)13-7-17/h6-15,25H,5,16H2,1-4H3,(H,30,33)