2-methyl-5-[3-(2-methylsulfanylpropan-2-ylamino)-2-oxidanyl-propoxy]-9H-pyrido[3,4-b]indol-1-one

Systemtic Name: 2-methyl-5-[3-(2-methylsulfanylpropan-2-ylamino)-2-oxidanyl-propoxy]-9H-pyrido[3,4-b]indol-1-one Openeye Name: 5-[2-hydroxy-3-[(1-methyl-1-methylsulfanyl-ethyl)amino]propoxy]-2-methyl-9H-pyrido[3,4-b]indol-1-one CAS Name: 5-[2-hydroxy-3-[2-(methylthio)propan-2-ylamino]propoxy]-2-methyl-9H-pyrido[3,4-b]indol-1-one IUPAC Name: 5-[2-hydroxy-3-(2-methylsulfanylpropan-2-ylamino)propoxy]-2-methyl-9H-pyrido[3,4-b]indol-1-one Traditional Name: 5-[2-hydroxy-3-[[1-methyl-1-(methylthio)ethyl]amino]propoxy]-2-methyl-9H-$b-carbolin-1-one Formula: C19H25N3O3S MolecularWeight: 375.4851

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(NCC(COC1=CC=CC2=C1C3=C(N2)C(=O)N(C=C3)C)O)SC

Isomeric SMILES

CC(C)(NCC(COC1=CC=CC2=C1C3=C(N2)C(=O)N(C=C3)C)O)SC

InChI

InChI=1S/C19H25N3O3S/c1-19(2,26-4)20-10-12(23)11-25-15-7-5-6-14-16(15)13-8-9-22(3)18(24)17(13)21-14/h5-9,12,20-21,23H,10-11H2,1-4H3