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

Systemtic Name: N-(3-chloranyl-4-methyl-phenyl)-2-[6,7-dimethoxy-3-[(4-methoxyphenyl)methyl]-4-oxidanylidene-quinazolin-2-yl]sulfanyl-butanamide Openeye Name: N-(3-chloro-4-methyl-phenyl)-2-[6,7-dimethoxy-3-[(4-methoxyphenyl)methyl]-4-oxo-quinazolin-2-yl]sulfanyl-butanamide CAS Name: N-(3-chloro-4-methylphenyl)-2-[[6,7-dimethoxy-3-[(4-methoxyphenyl)methyl]-4-oxo-2-quinazolinyl]thio]butanamide IUPAC Name: N-(3-chloro-4-methylphenyl)-2-[6,7-dimethoxy-3-[(4-methoxyphenyl)methyl]-4-oxoquinazolin-2-yl]sulfanylbutanamide Traditional Name: N-(3-chloro-4-methyl-phenyl)-2-[(4-keto-6,7-dimethoxy-3-p-anisyl-quinazolin-2-yl)thio]butyramide Formula: C29H30ClN3O5S MolecularWeight: 568.0836

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C29H30ClN3O5S/c1-6-26(27(34)31-19-10-7-17(2)22(30)13-19)39-29-32-23-15-25(38-5)24(37-4)14-21(23)28(35)33(29)16-18-8-11-20(36-3)12-9-18/h7-15,26H,6,16H2,1-5H3,(H,31,34)