7-chloranyl-3-(2-methoxyethyl)-2-[(7-methyl-2-oxidanylidene-chromen-4-yl)methylsulfanyl]quinazolin-4-one

Systemtic Name: 7-chloranyl-3-(2-methoxyethyl)-2-[(7-methyl-2-oxidanylidene-chromen-4-yl)methylsulfanyl]quinazolin-4-one Openeye Name: 7-chloro-3-(2-methoxyethyl)-2-[(7-methyl-2-oxo-chromen-4-yl)methylsulfanyl]quinazolin-4-one CAS Name: 7-chloro-3-(2-methoxyethyl)-2-[(7-methyl-2-oxo-1-benzopyran-4-yl)methylthio]-4-quinazolinone IUPAC Name: 7-chloro-3-(2-methoxyethyl)-2-[(7-methyl-2-oxochromen-4-yl)methylsulfanyl]quinazolin-4-one Traditional Name: 7-chloro-2-[(2-keto-7-methyl-chromen-4-yl)methylthio]-3-(2-methoxyethyl)quinazolin-4-one Formula: C22H19ClN2O4S MolecularWeight: 442.91526

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=CC(=O)O2)CSC3=NC4=C(C=CC(=C4)Cl)C(=O)N3CCOC

Isomeric SMILES

CC1=CC2=C(C=C1)C(=CC(=O)O2)CSC3=NC4=C(C=CC(=C4)Cl)C(=O)N3CCOC

InChI

InChI=1S/C22H19ClN2O4S/c1-13-3-5-16-14(10-20(26)29-19(16)9-13)12-30-22-24-18-11-15(23)4-6-17(18)21(27)25(22)7-8-28-2/h3-6,9-11H,7-8,12H2,1-2H3