3-ethyl-2-phenacylsulfanyl-5H-pyrimido[5,4-b]indol-4-one

Systemtic Name: 3-ethyl-2-phenacylsulfanyl-5H-pyrimido[5,4-b]indol-4-one Openeye Name: 3-ethyl-2-phenacylsulfanyl-5H-pyrimido[5,4-b]indol-4-one CAS Name: 3-ethyl-2-(phenacylthio)-5H-pyrimido[5,4-b]indol-4-one IUPAC Name: 3-ethyl-2-phenacylsulfanyl-5H-pyrimido[5,4-b]indol-4-one Traditional Name: 3-ethyl-2-(phenacylthio)-5H-pyrimid[5,4-b]indol-4-one Formula: C20H17N3O2S MolecularWeight: 363.43288

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(C3=CC=CC=C3N2)N=C1SCC(=O)C4=CC=CC=C4

Isomeric SMILES

CCN1C(=O)C2=C(C3=CC=CC=C3N2)N=C1SCC(=O)C4=CC=CC=C4

InChI

InChI=1S/C20H17N3O2S/c1-2-23-19(25)18-17(14-10-6-7-11-15(14)21-18)22-20(23)26-12-16(24)13-8-4-3-5-9-13/h3-11,21H,2,12H2,1H3