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

Systemtic Name: 2-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxidanylidene-ethyl]sulfanyl-3-methyl-5H-pyrimido[5,4-b]indol-4-one Openeye Name: 2-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxo-ethyl]sulfanyl-3-methyl-5H-pyrimido[5,4-b]indol-4-one CAS Name: 2-[[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]thio]-3-methyl-5H-pyrimido[5,4-b]indol-4-one IUPAC Name: 2-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]sulfanyl-3-methyl-5H-pyrimido[5,4-b]indol-4-one Traditional Name: 2-[[2-(3,4-dihydro-2H-quinolin-1-yl)-2-keto-ethyl]thio]-3-methyl-5H-pyrimid[5,4-b]indol-4-one Formula: C22H20N4O2S MolecularWeight: 404.4848

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(C3=CC=CC=C3N2)N=C1SCC(=O)N4CCCC5=CC=CC=C54

Isomeric SMILES

CN1C(=O)C2=C(C3=CC=CC=C3N2)N=C1SCC(=O)N4CCCC5=CC=CC=C54

InChI

InChI=1S/C22H20N4O2S/c1-25-21(28)20-19(15-9-3-4-10-16(15)23-20)24-22(25)29-13-18(27)26-12-6-8-14-7-2-5-11-17(14)26/h2-5,7,9-11,23H,6,8,12-13H2,1H3