N-(4-acetamido-3-chloranyl-phenyl)-6-methyl-1-(thiophen-2-ylmethyl)pyrazolo[3,4-b]pyridine-4-carboxamide

Systemtic Name: N-(4-acetamido-3-chloranyl-phenyl)-6-methyl-1-(thiophen-2-ylmethyl)pyrazolo[3,4-b]pyridine-4-carboxamide Openeye Name: N-(4-acetamido-3-chloro-phenyl)-6-methyl-1-(2-thienylmethyl)pyrazolo[3,4-b]pyridine-4-carboxamide CAS Name: N-(4-acetamido-3-chlorophenyl)-6-methyl-1-(thiophen-2-ylmethyl)-4-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: N-(4-acetamido-3-chlorophenyl)-6-methyl-1-(thiophen-2-ylmethyl)pyrazolo[3,4-b]pyridine-4-carboxamide Traditional Name: N-(4-acetamido-3-chloro-phenyl)-6-methyl-1-(2-thenyl)pyrazolo[3,4-b]pyridine-4-carboxamide Formula: C21H18ClN5O2S MolecularWeight: 439.91792

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=NN2CC3=CC=CS3)C(=C1)C(=O)NC4=CC(=C(C=C4)NC(=O)C)Cl

Isomeric SMILES

CC1=NC2=C(C=NN2CC3=CC=CS3)C(=C1)C(=O)NC4=CC(=C(C=C4)NC(=O)C)Cl

InChI

InChI=1S/C21H18ClN5O2S/c1-12-8-16(17-10-23-27(20(17)24-12)11-15-4-3-7-30-15)21(29)26-14-5-6-19(18(22)9-14)25-13(2)28/h3-10H,11H2,1-2H3,(H,25,28)(H,26,29)