3-(2-methylphenyl)-2-propylsulfanyl-5H-pyrimido[5,4-b]indol-4-one

Systemtic Name: 3-(2-methylphenyl)-2-propylsulfanyl-5H-pyrimido[5,4-b]indol-4-one Openeye Name: 3-(o-tolyl)-2-propylsulfanyl-5H-pyrimido[5,4-b]indol-4-one CAS Name: 3-(2-methylphenyl)-2-(propylthio)-5H-pyrimido[5,4-b]indol-4-one IUPAC Name: 3-(2-methylphenyl)-2-propylsulfanyl-5H-pyrimido[5,4-b]indol-4-one Traditional Name: 3-(o-tolyl)-2-(propylthio)-5H-pyrimid[5,4-b]indol-4-one Formula: C20H19N3OS MolecularWeight: 349.44936

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NC2=C(C(=O)N1C3=CC=CC=C3C)NC4=CC=CC=C42

Isomeric SMILES

CCCSC1=NC2=C(C(=O)N1C3=CC=CC=C3C)NC4=CC=CC=C42

InChI

InChI=1S/C20H19N3OS/c1-3-12-25-20-22-17-14-9-5-6-10-15(14)21-18(17)19(24)23(20)16-11-7-4-8-13(16)2/h4-11,21H,3,12H2,1-2H3