N5-(4-azanylcyclohexyl)-N7-(4-ethoxyphenyl)-6-methyl-pyrazolo[1,5-a]pyrimidine-5,7-diamine

Systemtic Name: N5-(4-azanylcyclohexyl)-N7-(4-ethoxyphenyl)-6-methyl-pyrazolo[1,5-a]pyrimidine-5,7-diamine Openeye Name: N5-(4-aminocyclohexyl)-N7-(4-ethoxyphenyl)-6-methyl-pyrazolo[1,5-a]pyrimidine-5,7-diamine CAS Name: N5-(4-aminocyclohexyl)-N7-(4-ethoxyphenyl)-6-methylpyrazolo[1,5-a]pyrimidine-5,7-diamine IUPAC Name: 5-N-(4-aminocyclohexyl)-7-N-(4-ethoxyphenyl)-6-methylpyrazolo[1,5-a]pyrimidine-5,7-diamine Traditional Name: (4-aminocyclohexyl)-[6-methyl-7-(p-phenetidino)pyrazolo[1,5-a]pyrimidin-5-yl]amine Formula: C21H28N6O MolecularWeight: 380.48662

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC2=C(C(=NC3=CC=NN32)NC4CCC(CC4)N)C

Isomeric SMILES

CCOC1=CC=C(C=C1)NC2=C(C(=NC3=CC=NN32)NC4CCC(CC4)N)C

InChI

InChI=1S/C21H28N6O/c1-3-28-18-10-8-17(9-11-18)25-21-14(2)20(26-19-12-13-23-27(19)21)24-16-6-4-15(22)5-7-16/h8-13,15-16,25H,3-7,22H2,1-2H3,(H,24,26)