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

Systemtic Name: 2-[(7-methyl-2-oxidanylidene-chromen-4-yl)methylsulfanyl]-3-propyl-quinazolin-4-one Openeye Name: 2-[(7-methyl-2-oxo-chromen-4-yl)methylsulfanyl]-3-propyl-quinazolin-4-one CAS Name: 2-[(7-methyl-2-oxo-1-benzopyran-4-yl)methylthio]-3-propyl-4-quinazolinone IUPAC Name: 2-[(7-methyl-2-oxochromen-4-yl)methylsulfanyl]-3-propylquinazolin-4-one Traditional Name: 2-[(2-keto-7-methyl-chromen-4-yl)methylthio]-3-propyl-quinazolin-4-one Formula: C22H20N2O3S MolecularWeight: 392.4708

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2N=C1SCC3=CC(=O)OC4=C3C=CC(=C4)C

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2N=C1SCC3=CC(=O)OC4=C3C=CC(=C4)C

InChI

InChI=1S/C22H20N2O3S/c1-3-10-24-21(26)17-6-4-5-7-18(17)23-22(24)28-13-15-12-20(25)27-19-11-14(2)8-9-16(15)19/h4-9,11-12H,3,10,13H2,1-2H3