5-[2-[(4-morpholin-4-ylcarbonylphenyl)amino]pyridin-4-yl]-2-piperazin-1-yl-1H-pyrrole-3-carbonitrile

Systemtic Name: 5-[2-[(4-morpholin-4-ylcarbonylphenyl)amino]pyridin-4-yl]-2-piperazin-1-yl-1H-pyrrole-3-carbonitrile Openeye Name: 5-[2-[4-(morpholine-4-carbonyl)anilino]-4-pyridyl]-2-piperazin-1-yl-1H-pyrrole-3-carbonitrile CAS Name: 5-[2-[4-[4-morpholinyl(oxo)methyl]anilino]-4-pyridinyl]-2-(1-piperazinyl)-1H-pyrrole-3-carbonitrile IUPAC Name: 5-[2-[4-(morpholine-4-carbonyl)anilino]pyridin-4-yl]-2-piperazin-1-yl-1H-pyrrole-3-carbonitrile Traditional Name: 5-[2-[4-(morpholine-4-carbonyl)anilino]-4-pyridyl]-2-piperazino-1H-pyrrole-3-carbonitrile Formula: C25H27N7O2 MolecularWeight: 457.52758

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=C(C=C(N2)C3=CC(=NC=C3)NC4=CC=C(C=C4)C(=O)N5CCOCC5)C#N

Isomeric SMILES

C1CN(CCN1)C2=C(C=C(N2)C3=CC(=NC=C3)NC4=CC=C(C=C4)C(=O)N5CCOCC5)C#N

InChI

InChI=1S/C25H27N7O2/c26-17-20-15-22(30-24(20)31-9-7-27-8-10-31)19-5-6-28-23(16-19)29-21-3-1-18(2-4-21)25(33)32-11-13-34-14-12-32/h1-6,15-16,27,30H,7-14H2,(H,28,29)