N-(5-chloranyl-2,4-dimethoxy-phenyl)-2-(4-oxidanylidene-3-phenyl-quinazolin-2-yl)sulfanyl-butanamide

Systemtic Name: N-(5-chloranyl-2,4-dimethoxy-phenyl)-2-(4-oxidanylidene-3-phenyl-quinazolin-2-yl)sulfanyl-butanamide Openeye Name: N-(5-chloro-2,4-dimethoxy-phenyl)-2-(4-oxo-3-phenyl-quinazolin-2-yl)sulfanyl-butanamide CAS Name: N-(5-chloro-2,4-dimethoxyphenyl)-2-[(4-oxo-3-phenyl-2-quinazolinyl)thio]butanamide IUPAC Name: N-(5-chloro-2,4-dimethoxyphenyl)-2-(4-oxo-3-phenylquinazolin-2-yl)sulfanylbutanamide Traditional Name: N-(5-chloro-2,4-dimethoxy-phenyl)-2-[(4-keto-3-phenyl-quinazolin-2-yl)thio]butyramide Formula: C26H24ClN3O4S MolecularWeight: 510.00446

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC(=C(C=C1OC)OC)Cl)SC2=NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4

Isomeric SMILES

CCC(C(=O)NC1=CC(=C(C=C1OC)OC)Cl)SC2=NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4

InChI

InChI=1S/C26H24ClN3O4S/c1-4-23(24(31)28-20-14-18(27)21(33-2)15-22(20)34-3)35-26-29-19-13-9-8-12-17(19)25(32)30(26)16-10-6-5-7-11-16/h5-15,23H,4H2,1-3H3,(H,28,31)