dimethyl-[3-[(1-propan-2-ylpyrazolo[3,4-b]pyridin-5-yl)carbamothioylamino]propyl]azanium

Systemtic Name: dimethyl-[3-[(1-propan-2-ylpyrazolo[3,4-b]pyridin-5-yl)carbamothioylamino]propyl]azanium Openeye Name: 3-[(1-isopropylpyrazolo[3,4-b]pyridin-5-yl)carbamothioylamino]propyl-dimethyl-ammonium CAS Name: dimethyl-[3-[[[(1-propan-2-yl-5-pyrazolo[3,4-b]pyridinyl)amino]-sulfanylidenemethyl]amino]propyl]ammonium IUPAC Name: dimethyl-[3-[(1-propan-2-ylpyrazolo[3,4-b]pyridin-5-yl)carbamothioylamino]propyl]azanium Traditional Name: 3-[(1-isopropylpyrazolo[3,4-b]pyridin-5-yl)thiocarbamoylamino]propyl-dimethyl-ammonium Formula: C15H25N6S+ MolecularWeight: 321.4642

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C2=NC=C(C=C2C=N1)NC(=S)NCCC[NH+](C)C

Isomeric SMILES

CC(C)N1C2=NC=C(C=C2C=N1)NC(=S)NCCC[NH+](C)C

InChI

InChI=1S/C15H24N6S/c1-11(2)21-14-12(9-18-21)8-13(10-17-14)19-15(22)16-6-5-7-20(3)4/h8-11H,5-7H2,1-4H3,(H2,16,19,22)/p+1