3-azanyl-9-methylsulfanyl-5,6-dihydro-4H-benzo[f]quinazolin-1-one

Systemtic Name: 3-azanyl-9-methylsulfanyl-5,6-dihydro-4H-benzo[f]quinazolin-1-one Openeye Name: 3-amino-9-methylsulfanyl-5,6-dihydro-4H-benzo[f]quinazolin-1-one CAS Name: 3-amino-9-(methylthio)-5,6-dihydro-4H-benzo[f]quinazolin-1-one IUPAC Name: 3-amino-9-methylsulfanyl-5,6-dihydro-4H-benzo[f]quinazolin-1-one Traditional Name: 3-amino-9-(methylthio)-5,6-dihydro-4H-benzo[f]quinazolin-1-one Formula: C13H13N3OS MolecularWeight: 259.32682

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC2=C(CCC3=C2C(=O)N=C(N3)N)C=C1

Isomeric SMILES

CSC1=CC2=C(CCC3=C2C(=O)N=C(N3)N)C=C1

InChI

InChI=1S/C13H13N3OS/c1-18-8-4-2-7-3-5-10-11(9(7)6-8)12(17)16-13(14)15-10/h2,4,6H,3,5H2,1H3,(H3,14,15,16,17)