7-chloranyl-2-[(7,8-dimethyl-2-oxidanylidene-chromen-4-yl)methylsulfanyl]-3-(3-methylbutyl)quinazolin-4-one

Systemtic Name: 7-chloranyl-2-[(7,8-dimethyl-2-oxidanylidene-chromen-4-yl)methylsulfanyl]-3-(3-methylbutyl)quinazolin-4-one Openeye Name: 7-chloro-2-[(7,8-dimethyl-2-oxo-chromen-4-yl)methylsulfanyl]-3-isopentyl-quinazolin-4-one CAS Name: 7-chloro-2-[(7,8-dimethyl-2-oxo-1-benzopyran-4-yl)methylthio]-3-(3-methylbutyl)-4-quinazolinone IUPAC Name: 7-chloro-2-[(7,8-dimethyl-2-oxochromen-4-yl)methylsulfanyl]-3-(3-methylbutyl)quinazolin-4-one Traditional Name: 7-chloro-3-isoamyl-2-[(2-keto-7,8-dimethyl-chromen-4-yl)methylthio]quinazolin-4-one Formula: C25H25ClN2O3S MolecularWeight: 468.9956

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C(=CC(=O)O2)CSC3=NC4=C(C=CC(=C4)Cl)C(=O)N3CCC(C)C)C

Isomeric SMILES

CC1=C(C2=C(C=C1)C(=CC(=O)O2)CSC3=NC4=C(C=CC(=C4)Cl)C(=O)N3CCC(C)C)C

InChI

InChI=1S/C25H25ClN2O3S/c1-14(2)9-10-28-24(30)20-8-6-18(26)12-21(20)27-25(28)32-13-17-11-22(29)31-23-16(4)15(3)5-7-19(17)23/h5-8,11-12,14H,9-10,13H2,1-4H3