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

Systemtic Name: 2-(2-hydroxyethylsulfanyl)-3-(2-methylphenyl)-5H-pyrimido[5,4-b]indol-4-one Openeye Name: 2-(2-hydroxyethylsulfanyl)-3-(o-tolyl)-5H-pyrimido[5,4-b]indol-4-one CAS Name: 2-(2-hydroxyethylthio)-3-(2-methylphenyl)-5H-pyrimido[5,4-b]indol-4-one IUPAC Name: 2-(2-hydroxyethylsulfanyl)-3-(2-methylphenyl)-5H-pyrimido[5,4-b]indol-4-one Traditional Name: 2-(2-hydroxyethylthio)-3-(o-tolyl)-5H-pyrimid[5,4-b]indol-4-one Formula: C19H17N3O2S MolecularWeight: 351.42218

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=O)C3=C(C4=CC=CC=C4N3)N=C2SCCO

Isomeric SMILES

CC1=CC=CC=C1N2C(=O)C3=C(C4=CC=CC=C4N3)N=C2SCCO

InChI

InChI=1S/C19H17N3O2S/c1-12-6-2-5-9-15(12)22-18(24)17-16(21-19(22)25-11-10-23)13-7-3-4-8-14(13)20-17/h2-9,20,23H,10-11H2,1H3