4-[4-(aminomethyl)piperidin-1-yl]-N-(4-piperazin-1-ylphenyl)-7H-pyrrolo[2,3-d]pyrimidin-2-amine

Systemtic Name: 4-[4-(aminomethyl)piperidin-1-yl]-N-(4-piperazin-1-ylphenyl)-7H-pyrrolo[2,3-d]pyrimidin-2-amine Openeye Name: 4-[4-(aminomethyl)-1-piperidyl]-N-(4-piperazin-1-ylphenyl)-7H-pyrrolo[2,3-d]pyrimidin-2-amine CAS Name: 4-[4-(aminomethyl)-1-piperidinyl]-N-[4-(1-piperazinyl)phenyl]-7H-pyrrolo[2,3-d]pyrimidin-2-amine IUPAC Name: 4-[4-(aminomethyl)piperidin-1-yl]-N-(4-piperazin-1-ylphenyl)-7H-pyrrolo[2,3-d]pyrimidin-2-amine Traditional Name: [4-[4-(aminomethyl)piperidino]-7H-pyrrolo[2,3-d]pyrimidin-2-yl]-(4-piperazinophenyl)amine Formula: C22H30N8 MolecularWeight: 406.5272

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CN)C2=NC(=NC3=C2C=CN3)NC4=CC=C(C=C4)N5CCNCC5

Isomeric SMILES

C1CN(CCC1CN)C2=NC(=NC3=C2C=CN3)NC4=CC=C(C=C4)N5CCNCC5

InChI

InChI=1S/C22H30N8/c23-15-16-6-11-30(12-7-16)21-19-5-8-25-20(19)27-22(28-21)26-17-1-3-18(4-2-17)29-13-9-24-10-14-29/h1-5,8,16,24H,6-7,9-15,23H2,(H2,25,26,27,28)