2-[(6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methylsulfanyl]-3-propan-2-yl-quinazolin-4-one

Systemtic Name: 2-[(6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methylsulfanyl]-3-propan-2-yl-quinazolin-4-one Openeye Name: 2-[(6,7-dimethyl-2-oxo-chromen-4-yl)methylsulfanyl]-3-isopropyl-quinazolin-4-one CAS Name: 2-[(6,7-dimethyl-2-oxo-1-benzopyran-4-yl)methylthio]-3-propan-2-yl-4-quinazolinone IUPAC Name: 2-[(6,7-dimethyl-2-oxochromen-4-yl)methylsulfanyl]-3-propan-2-ylquinazolin-4-one Traditional Name: 3-isopropyl-2-[(2-keto-6,7-dimethyl-chromen-4-yl)methylthio]quinazolin-4-one Formula: C23H22N2O3S MolecularWeight: 406.49738

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=CC(=O)O2)CSC3=NC4=CC=CC=C4C(=O)N3C(C)C)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=CC(=O)O2)CSC3=NC4=CC=CC=C4C(=O)N3C(C)C)C

InChI

InChI=1S/C23H22N2O3S/c1-13(2)25-22(27)17-7-5-6-8-19(17)24-23(25)29-12-16-11-21(26)28-20-10-15(4)14(3)9-18(16)20/h5-11,13H,12H2,1-4H3