2-[2-(2,3-dihydroindol-1-yl)-2-oxidanylidene-ethyl]sulfanyl-3-methyl-5H-pyrimido[5,4-b]indol-4-one

Systemtic Name: 2-[2-(2,3-dihydroindol-1-yl)-2-oxidanylidene-ethyl]sulfanyl-3-methyl-5H-pyrimido[5,4-b]indol-4-one Openeye Name: 2-(2-indolin-1-yl-2-oxo-ethyl)sulfanyl-3-methyl-5H-pyrimido[5,4-b]indol-4-one CAS Name: 2-[[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]thio]-3-methyl-5H-pyrimido[5,4-b]indol-4-one IUPAC Name: 2-[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]sulfanyl-3-methyl-5H-pyrimido[5,4-b]indol-4-one Traditional Name: 2-[(2-indolin-1-yl-2-keto-ethyl)thio]-3-methyl-5H-pyrimid[5,4-b]indol-4-one Formula: C21H18N4O2S MolecularWeight: 390.45822

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(C3=CC=CC=C3N2)N=C1SCC(=O)N4CCC5=CC=CC=C54

Isomeric SMILES

CN1C(=O)C2=C(C3=CC=CC=C3N2)N=C1SCC(=O)N4CCC5=CC=CC=C54

InChI

InChI=1S/C21H18N4O2S/c1-24-20(27)19-18(14-7-3-4-8-15(14)22-19)23-21(24)28-12-17(26)25-11-10-13-6-2-5-9-16(13)25/h2-9,22H,10-12H2,1H3