2-[(3-oxidanylidenebenzo[f]chromen-1-yl)methylsulfanyl]-3-propyl-quinazolin-4-one

Systemtic Name: 2-[(3-oxidanylidenebenzo[f]chromen-1-yl)methylsulfanyl]-3-propyl-quinazolin-4-one Openeye Name: 2-[(3-oxobenzo[f]chromen-1-yl)methylsulfanyl]-3-propyl-quinazolin-4-one CAS Name: 2-[(3-oxo-1-benzo[f][1]benzopyranyl)methylthio]-3-propyl-4-quinazolinone IUPAC Name: 2-[(3-oxobenzo[f]chromen-1-yl)methylsulfanyl]-3-propylquinazolin-4-one Traditional Name: 2-[(3-ketobenzo[f]chromen-1-yl)methylthio]-3-propyl-quinazolin-4-one Formula: C25H20N2O3S MolecularWeight: 428.5029

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2N=C1SCC3=CC(=O)OC4=C3C5=CC=CC=C5C=C4

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2N=C1SCC3=CC(=O)OC4=C3C5=CC=CC=C5C=C4

InChI

InChI=1S/C25H20N2O3S/c1-2-13-27-24(29)19-9-5-6-10-20(19)26-25(27)31-15-17-14-22(28)30-21-12-11-16-7-3-4-8-18(16)23(17)21/h3-12,14H,2,13,15H2,1H3