5-[2-[6-(4-methyl-1,4-diazepan-1-yl)pyridin-3-yl]pyridin-4-yl]-2-piperazin-1-yl-1H-pyrrole-3-carbonitrile

Systemtic Name: 5-[2-[6-(4-methyl-1,4-diazepan-1-yl)pyridin-3-yl]pyridin-4-yl]-2-piperazin-1-yl-1H-pyrrole-3-carbonitrile Openeye Name: 5-[2-[6-(4-methyl-1,4-diazepan-1-yl)-3-pyridyl]-4-pyridyl]-2-piperazin-1-yl-1H-pyrrole-3-carbonitrile CAS Name: 5-[2-[6-(4-methyl-1,4-diazepan-1-yl)-3-pyridinyl]-4-pyridinyl]-2-(1-piperazinyl)-1H-pyrrole-3-carbonitrile IUPAC Name: 5-[2-[6-(4-methyl-1,4-diazepan-1-yl)pyridin-3-yl]pyridin-4-yl]-2-piperazin-1-yl-1H-pyrrole-3-carbonitrile Traditional Name: 5-[2-[6-(4-methyl-1,4-diazepan-1-yl)-3-pyridyl]-4-pyridyl]-2-piperazino-1H-pyrrole-3-carbonitrile Formula: C25H30N8 MolecularWeight: 442.5593

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCN(CC1)C2=NC=C(C=C2)C3=NC=CC(=C3)C4=CC(=C(N4)N5CCNCC5)C#N

Isomeric SMILES

CN1CCCN(CC1)C2=NC=C(C=C2)C3=NC=CC(=C3)C4=CC(=C(N4)N5CCNCC5)C#N

InChI

InChI=1S/C25H30N8/c1-31-9-2-10-32(14-13-31)24-4-3-20(18-29-24)22-15-19(5-6-28-22)23-16-21(17-26)25(30-23)33-11-7-27-8-12-33/h3-6,15-16,18,27,30H,2,7-14H2,1H3