1-cyclohexyl-4-[(3-methoxyphenyl)amino]-3-methyl-pyrazolo[3,4-b]pyridine-5-carboxamide

Systemtic Name: 1-cyclohexyl-4-[(3-methoxyphenyl)amino]-3-methyl-pyrazolo[3,4-b]pyridine-5-carboxamide Openeye Name: 1-cyclohexyl-4-(3-methoxyanilino)-3-methyl-pyrazolo[3,4-b]pyridine-5-carboxamide CAS Name: 1-cyclohexyl-4-(3-methoxyanilino)-3-methyl-5-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: 1-cyclohexyl-4-(3-methoxyanilino)-3-methylpyrazolo[3,4-b]pyridine-5-carboxamide Traditional Name: 1-cyclohexyl-4-(m-anisidino)-3-methyl-pyrazolo[3,4-b]pyridine-5-carboxamide Formula: C21H25N5O2 MolecularWeight: 379.4555

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=NC=C(C(=C12)NC3=CC(=CC=C3)OC)C(=O)N)C4CCCCC4

Isomeric SMILES

CC1=NN(C2=NC=C(C(=C12)NC3=CC(=CC=C3)OC)C(=O)N)C4CCCCC4

InChI

InChI=1S/C21H25N5O2/c1-13-18-19(24-14-7-6-10-16(11-14)28-2)17(20(22)27)12-23-21(18)26(25-13)15-8-4-3-5-9-15/h6-7,10-12,15H,3-5,8-9H2,1-2H3,(H2,22,27)(H,23,24)