2-[3-(1,3-benzodioxol-5-yl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(3-chloranyl-4-methyl-phenyl)ethanamide

Systemtic Name: 2-[3-(1,3-benzodioxol-5-yl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(3-chloranyl-4-methyl-phenyl)ethanamide Openeye Name: 2-[3-(1,3-benzodioxol-5-yl)-4-oxo-quinazolin-2-yl]sulfanyl-N-(3-chloro-4-methyl-phenyl)acetamide CAS Name: 2-[[3-(1,3-benzodioxol-5-yl)-4-oxo-2-quinazolinyl]thio]-N-(3-chloro-4-methylphenyl)acetamide IUPAC Name: 2-[3-(1,3-benzodioxol-5-yl)-4-oxoquinazolin-2-yl]sulfanyl-N-(3-chloro-4-methylphenyl)acetamide Traditional Name: 2-[[3-(1,3-benzodioxol-5-yl)-4-keto-quinazolin-2-yl]thio]-N-(3-chloro-4-methyl-phenyl)acetamide Formula: C24H18ClN3O4S MolecularWeight: 479.93542

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC5=C(C=C4)OCO5)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC5=C(C=C4)OCO5)Cl

InChI

InChI=1S/C24H18ClN3O4S/c1-14-6-7-15(10-18(14)25)26-22(29)12-33-24-27-19-5-3-2-4-17(19)23(30)28(24)16-8-9-20-21(11-16)32-13-31-20/h2-11H,12-13H2,1H3,(H,26,29)