1,5-dimethyl-4-[[(1-pyrimidin-2-ylpiperidin-3-yl)amino]methyl]pyrrole-2-carbonitrile

Systemtic Name: 1,5-dimethyl-4-[[(1-pyrimidin-2-ylpiperidin-3-yl)amino]methyl]pyrrole-2-carbonitrile Openeye Name: 1,5-dimethyl-4-[[(1-pyrimidin-2-yl-3-piperidyl)amino]methyl]pyrrole-2-carbonitrile CAS Name: 1,5-dimethyl-4-[[[1-(2-pyrimidinyl)-3-piperidinyl]amino]methyl]-2-pyrrolecarbonitrile IUPAC Name: 1,5-dimethyl-4-[[(1-pyrimidin-2-ylpiperidin-3-yl)amino]methyl]pyrrole-2-carbonitrile Traditional Name: 1,5-dimethyl-4-[[[1-(2-pyrimidyl)-3-piperidyl]amino]methyl]pyrrole-2-carbonitrile Formula: C17H22N6 MolecularWeight: 310.39678

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(N1C)C#N)CNC2CCCN(C2)C3=NC=CC=N3

Isomeric SMILES

CC1=C(C=C(N1C)C#N)CNC2CCCN(C2)C3=NC=CC=N3

InChI

InChI=1S/C17H22N6/c1-13-14(9-16(10-18)22(13)2)11-21-15-5-3-8-23(12-15)17-19-6-4-7-20-17/h4,6-7,9,15,21H,3,5,8,11-12H2,1-2H3