1-[2-[2-[[5-(3-cyanophenyl)pyridin-2-yl]amino]ethylamino]ethanoyl]pyrrolidine-2-carbonitrile

Systemtic Name: 1-[2-[2-[[5-(3-cyanophenyl)pyridin-2-yl]amino]ethylamino]ethanoyl]pyrrolidine-2-carbonitrile Openeye Name: 1-[2-[2-[[5-(3-cyanophenyl)-2-pyridyl]amino]ethylamino]acetyl]pyrrolidine-2-carbonitrile CAS Name: 1-[2-[2-[[5-(3-cyanophenyl)-2-pyridinyl]amino]ethylamino]-1-oxoethyl]-2-pyrrolidinecarbonitrile IUPAC Name: 1-[2-[2-[[5-(3-cyanophenyl)pyridin-2-yl]amino]ethylamino]acetyl]pyrrolidine-2-carbonitrile Traditional Name: 1-[2-[2-[[5-(3-cyanophenyl)-2-pyridyl]amino]ethylamino]acetyl]pyrrolidine-2-carbonitrile Formula: C21H22N6O MolecularWeight: 374.43898

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)CNCCNC2=NC=C(C=C2)C3=CC=CC(=C3)C#N)C#N

Isomeric SMILES

C1CC(N(C1)C(=O)CNCCNC2=NC=C(C=C2)C3=CC=CC(=C3)C#N)C#N

InChI

InChI=1S/C21H22N6O/c22-12-16-3-1-4-17(11-16)18-6-7-20(26-14-18)25-9-8-24-15-21(28)27-10-2-5-19(27)13-23/h1,3-4,6-7,11,14,19,24H,2,5,8-10,15H2,(H,25,26)