N-(5-butyl-1,3,4-thiadiazol-2-yl)-1-(phenylmethyl)pyrazolo[3,4-b]pyridine-5-carboxamide

Systemtic Name: N-(5-butyl-1,3,4-thiadiazol-2-yl)-1-(phenylmethyl)pyrazolo[3,4-b]pyridine-5-carboxamide Openeye Name: 1-benzyl-N-(5-butyl-1,3,4-thiadiazol-2-yl)pyrazolo[3,4-b]pyridine-5-carboxamide CAS Name: N-(5-butyl-1,3,4-thiadiazol-2-yl)-1-(phenylmethyl)-5-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: 1-benzyl-N-(5-butyl-1,3,4-thiadiazol-2-yl)pyrazolo[3,4-b]pyridine-5-carboxamide Traditional Name: 1-benzyl-N-(5-butyl-1,3,4-thiadiazol-2-yl)pyrazolo[3,4-b]pyridine-5-carboxamide Formula: C20H20N6OS MolecularWeight: 392.4774

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NN=C(S1)NC(=O)C2=CN=C3C(=C2)C=NN3CC4=CC=CC=C4

Isomeric SMILES

CCCCC1=NN=C(S1)NC(=O)C2=CN=C3C(=C2)C=NN3CC4=CC=CC=C4

InChI

InChI=1S/C20H20N6OS/c1-2-3-9-17-24-25-20(28-17)23-19(27)16-10-15-12-22-26(18(15)21-11-16)13-14-7-5-4-6-8-14/h4-8,10-12H,2-3,9,13H2,1H3,(H,23,25,27)