N4-(4-azanylcyclohexyl)-6-(3,4-dimethoxyphenyl)pyrido[3,2-d]pyrimidine-2,4-diamine

Systemtic Name: N4-(4-azanylcyclohexyl)-6-(3,4-dimethoxyphenyl)pyrido[3,2-d]pyrimidine-2,4-diamine Openeye Name: N4-(4-aminocyclohexyl)-6-(3,4-dimethoxyphenyl)pyrido[3,2-d]pyrimidine-2,4-diamine CAS Name: N4-(4-aminocyclohexyl)-6-(3,4-dimethoxyphenyl)pyrido[3,2-d]pyrimidine-2,4-diamine IUPAC Name: 4-N-(4-aminocyclohexyl)-6-(3,4-dimethoxyphenyl)pyrido[3,2-d]pyrimidine-2,4-diamine Traditional Name: (4-aminocyclohexyl)-[2-amino-6-(3,4-dimethoxyphenyl)pyrido[3,2-d]pyrimidin-4-yl]amine Formula: C21H26N6O2 MolecularWeight: 394.47014

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NC3=C(C=C2)N=C(N=C3NC4CCC(CC4)N)N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NC3=C(C=C2)N=C(N=C3NC4CCC(CC4)N)N)OC

InChI

InChI=1S/C21H26N6O2/c1-28-17-10-3-12(11-18(17)29-2)15-8-9-16-19(25-15)20(27-21(23)26-16)24-14-6-4-13(22)5-7-14/h3,8-11,13-14H,4-7,22H2,1-2H3,(H3,23,24,26,27)