N4-(1-methylindazol-6-yl)-N2-(4-piperazin-1-ylphenyl)-7H-pyrrolo[2,3-d]pyrimidine-2,4-diamine

Systemtic Name: N4-(1-methylindazol-6-yl)-N2-(4-piperazin-1-ylphenyl)-7H-pyrrolo[2,3-d]pyrimidine-2,4-diamine Openeye Name: N4-(1-methylindazol-6-yl)-N2-(4-piperazin-1-ylphenyl)-7H-pyrrolo[2,3-d]pyrimidine-2,4-diamine CAS Name: N4-(1-methyl-6-indazolyl)-N2-[4-(1-piperazinyl)phenyl]-7H-pyrrolo[2,3-d]pyrimidine-2,4-diamine IUPAC Name: 4-N-(1-methylindazol-6-yl)-2-N-(4-piperazin-1-ylphenyl)-7H-pyrrolo[2,3-d]pyrimidine-2,4-diamine Traditional Name: (1-methylindazol-6-yl)-[2-(4-piperazinoanilino)-7H-pyrrolo[2,3-d]pyrimidin-4-yl]amine Formula: C24H25N9 MolecularWeight: 439.5156

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=CC(=C2)NC3=NC(=NC4=C3C=CN4)NC5=CC=C(C=C5)N6CCNCC6)C=N1

Isomeric SMILES

CN1C2=C(C=CC(=C2)NC3=NC(=NC4=C3C=CN4)NC5=CC=C(C=C5)N6CCNCC6)C=N1

InChI

InChI=1S/C24H25N9/c1-32-21-14-18(3-2-16(21)15-27-32)28-23-20-8-9-26-22(20)30-24(31-23)29-17-4-6-19(7-5-17)33-12-10-25-11-13-33/h2-9,14-15,25H,10-13H2,1H3,(H3,26,28,29,30,31)