N-[4-[4-(4-cyano-5-piperazin-1-yl-1H-pyrrol-2-yl)pyridin-2-yl]phenyl]ethanamide

Systemtic Name: N-[4-[4-(4-cyano-5-piperazin-1-yl-1H-pyrrol-2-yl)pyridin-2-yl]phenyl]ethanamide Openeye Name: N-[4-[4-(4-cyano-5-piperazin-1-yl-1H-pyrrol-2-yl)-2-pyridyl]phenyl]acetamide CAS Name: N-[4-[4-[4-cyano-5-(1-piperazinyl)-1H-pyrrol-2-yl]-2-pyridinyl]phenyl]acetamide IUPAC Name: N-[4-[4-(4-cyano-5-piperazin-1-yl-1H-pyrrol-2-yl)pyridin-2-yl]phenyl]acetamide Traditional Name: N-[4-[4-(4-cyano-5-piperazino-1H-pyrrol-2-yl)-2-pyridyl]phenyl]acetamide Formula: C22H22N6O MolecularWeight: 386.44968

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)C2=NC=CC(=C2)C3=CC(=C(N3)N4CCNCC4)C#N

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)C2=NC=CC(=C2)C3=CC(=C(N3)N4CCNCC4)C#N

InChI

InChI=1S/C22H22N6O/c1-15(29)26-19-4-2-16(3-5-19)20-12-17(6-7-25-20)21-13-18(14-23)22(27-21)28-10-8-24-9-11-28/h2-7,12-13,24,27H,8-11H2,1H3,(H,26,29)