2-ethanoyl-4-methyl-1-(5-phenylpyridin-2-yl)-3-(piperidin-4-ylamino)pyrrolidine-2-carbonitrile

Systemtic Name: 2-ethanoyl-4-methyl-1-(5-phenylpyridin-2-yl)-3-(piperidin-4-ylamino)pyrrolidine-2-carbonitrile Openeye Name: 2-acetyl-4-methyl-1-(5-phenyl-2-pyridyl)-3-(4-piperidylamino)pyrrolidine-2-carbonitrile CAS Name: 2-acetyl-4-methyl-1-(5-phenyl-2-pyridinyl)-3-(4-piperidinylamino)-2-pyrrolidinecarbonitrile IUPAC Name: 2-acetyl-4-methyl-1-(5-phenylpyridin-2-yl)-3-(piperidin-4-ylamino)pyrrolidine-2-carbonitrile Traditional Name: 2-acetyl-4-methyl-1-(5-phenyl-2-pyridyl)-3-(4-piperidylamino)pyrrolidine-2-carbonitrile Formula: C24H29N5O MolecularWeight: 403.51996

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CN(C(C1NC2CCNCC2)(C#N)C(=O)C)C3=NC=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

CC1CN(C(C1NC2CCNCC2)(C#N)C(=O)C)C3=NC=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C24H29N5O/c1-17-15-29(22-9-8-20(14-27-22)19-6-4-3-5-7-19)24(16-25,18(2)30)23(17)28-21-10-12-26-13-11-21/h3-9,14,17,21,23,26,28H,10-13,15H2,1-2H3