propan-2-yl 2-[(1,3-dimethyl-4-propan-2-ylsulfanyl-pyrazolo[3,4-b]pyridin-5-yl)carbonylamino]-4-methylsulfanyl-butanoate

Systemtic Name: propan-2-yl 2-[(1,3-dimethyl-4-propan-2-ylsulfanyl-pyrazolo[3,4-b]pyridin-5-yl)carbonylamino]-4-methylsulfanyl-butanoate Openeye Name: isopropyl 2-[(4-isopropylsulfanyl-1,3-dimethyl-pyrazolo[3,4-b]pyridine-5-carbonyl)amino]-4-methylsulfanyl-butanoate CAS Name: 2-[[[1,3-dimethyl-4-(propan-2-ylthio)-5-pyrazolo[3,4-b]pyridinyl]-oxomethyl]amino]-4-(methylthio)butanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[(1,3-dimethyl-4-propan-2-ylsulfanylpyrazolo[3,4-b]pyridine-5-carbonyl)amino]-4-methylsulfanylbutanoate Traditional Name: 2-[[4-(isopropylthio)-1,3-dimethyl-pyrazolo[3,4-b]pyridine-5-carbonyl]amino]-4-(methylthio)butyric acid isopropyl ester Formula: C20H30N4O3S2 MolecularWeight: 438.6072

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=NC=C(C(=C12)SC(C)C)C(=O)NC(CCSC)C(=O)OC(C)C)C

Isomeric SMILES

CC1=NN(C2=NC=C(C(=C12)SC(C)C)C(=O)NC(CCSC)C(=O)OC(C)C)C

InChI

InChI=1S/C20H30N4O3S2/c1-11(2)27-20(26)15(8-9-28-7)22-19(25)14-10-21-18-16(13(5)23-24(18)6)17(14)29-12(3)4/h10-12,15H,8-9H2,1-7H3,(H,22,25)