2-[(7-bromanyl-2-oxidanylidene-chromen-4-yl)methylsulfanyl]-3-cyclopentyl-quinazolin-4-one

Systemtic Name: 2-[(7-bromanyl-2-oxidanylidene-chromen-4-yl)methylsulfanyl]-3-cyclopentyl-quinazolin-4-one Openeye Name: 2-[(7-bromo-2-oxo-chromen-4-yl)methylsulfanyl]-3-cyclopentyl-quinazolin-4-one CAS Name: 2-[(7-bromo-2-oxo-1-benzopyran-4-yl)methylthio]-3-cyclopentyl-4-quinazolinone IUPAC Name: 2-[(7-bromo-2-oxochromen-4-yl)methylsulfanyl]-3-cyclopentylquinazolin-4-one Traditional Name: 2-[(7-bromo-2-keto-chromen-4-yl)methylthio]-3-cyclopentyl-quinazolin-4-one Formula: C23H19BrN2O3S MolecularWeight: 483.37756

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C(=O)C3=CC=CC=C3N=C2SCC4=CC(=O)OC5=C4C=CC(=C5)Br

Isomeric SMILES

C1CCC(C1)N2C(=O)C3=CC=CC=C3N=C2SCC4=CC(=O)OC5=C4C=CC(=C5)Br

InChI

InChI=1S/C23H19BrN2O3S/c24-15-9-10-17-14(11-21(27)29-20(17)12-15)13-30-23-25-19-8-4-3-7-18(19)22(28)26(23)16-5-1-2-6-16/h3-4,7-12,16H,1-2,5-6,13H2