1,3-dimethyl-4-propan-2-ylsulfanyl-N-prop-2-ynyl-pyrazolo[3,4-b]pyridine-5-carboxamide

Systemtic Name: 1,3-dimethyl-4-propan-2-ylsulfanyl-N-prop-2-ynyl-pyrazolo[3,4-b]pyridine-5-carboxamide Openeye Name: 4-isopropylsulfanyl-1,3-dimethyl-N-prop-2-ynyl-pyrazolo[3,4-b]pyridine-5-carboxamide CAS Name: 1,3-dimethyl-4-(propan-2-ylthio)-N-prop-2-ynyl-5-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: 1,3-dimethyl-4-propan-2-ylsulfanyl-N-prop-2-ynylpyrazolo[3,4-b]pyridine-5-carboxamide Traditional Name: 4-(isopropylthio)-1,3-dimethyl-N-propargyl-pyrazolo[3,4-b]pyridine-5-carboxamide Formula: C15H18N4OS MolecularWeight: 302.39462

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=NC=C(C(=C12)SC(C)C)C(=O)NCC#C)C

Isomeric SMILES

CC1=NN(C2=NC=C(C(=C12)SC(C)C)C(=O)NCC#C)C

InChI

InChI=1S/C15H18N4OS/c1-6-7-16-15(20)11-8-17-14-12(10(4)18-19(14)5)13(11)21-9(2)3/h1,8-9H,7H2,2-5H3,(H,16,20)