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

Systemtic Name: 3-(2-methylphenyl)-2-prop-2-enylsulfanyl-5H-pyrimido[5,4-b]indol-4-one Openeye Name: 2-allylsulfanyl-3-(o-tolyl)-5H-pyrimido[5,4-b]indol-4-one CAS Name: 3-(2-methylphenyl)-2-(prop-2-enylthio)-5H-pyrimido[5,4-b]indol-4-one IUPAC Name: 3-(2-methylphenyl)-2-prop-2-enylsulfanyl-5H-pyrimido[5,4-b]indol-4-one Traditional Name: 2-(allylthio)-3-(o-tolyl)-5H-pyrimid[5,4-b]indol-4-one Formula: C20H17N3OS MolecularWeight: 347.43348

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=O)C3=C(C4=CC=CC=C4N3)N=C2SCC=C

Isomeric SMILES

CC1=CC=CC=C1N2C(=O)C3=C(C4=CC=CC=C4N3)N=C2SCC=C

InChI

InChI=1S/C20H17N3OS/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/h3-11,21H,1,12H2,2H3