N-[1-[2-(1-methyl-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl)ethanoyl]piperidin-4-yl]thiophene-2-sulfonamide

Systemtic Name: N-[1-[2-(1-methyl-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl)ethanoyl]piperidin-4-yl]thiophene-2-sulfonamide Openeye Name: N-[1-[2-(1-methyl-4-oxo-pyrazolo[3,4-d]pyrimidin-5-yl)acetyl]-4-piperidyl]thiophene-2-sulfonamide CAS Name: N-[1-[2-(1-methyl-4-oxo-5-pyrazolo[3,4-d]pyrimidinyl)-1-oxoethyl]-4-piperidinyl]-2-thiophenesulfonamide IUPAC Name: N-[1-[2-(1-methyl-4-oxopyrazolo[3,4-d]pyrimidin-5-yl)acetyl]piperidin-4-yl]thiophene-2-sulfonamide Traditional Name: N-[1-[2-(4-keto-1-methyl-pyrazolo[3,4-d]pyrimidin-5-yl)acetyl]-4-piperidyl]thiophene-2-sulfonamide Formula: C17H20N6O4S2 MolecularWeight: 436.5085

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=O)N(C=N2)CC(=O)N3CCC(CC3)NS(=O)(=O)C4=CC=CS4

Isomeric SMILES

CN1C2=C(C=N1)C(=O)N(C=N2)CC(=O)N3CCC(CC3)NS(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C17H20N6O4S2/c1-21-16-13(9-19-21)17(25)23(11-18-16)10-14(24)22-6-4-12(5-7-22)20-29(26,27)15-3-2-8-28-15/h2-3,8-9,11-12,20H,4-7,10H2,1H3