N-[2-(4-tert-butyl-2,6-dimethyl-phenyl)ethyl]-4-(4-cyanopyridin-2-yl)piperazine-1-carboxamide

Systemtic Name: N-[2-(4-tert-butyl-2,6-dimethyl-phenyl)ethyl]-4-(4-cyanopyridin-2-yl)piperazine-1-carboxamide Openeye Name: N-[2-(4-tert-butyl-2,6-dimethyl-phenyl)ethyl]-4-(4-cyano-2-pyridyl)piperazine-1-carboxamide CAS Name: N-[2-(4-tert-butyl-2,6-dimethylphenyl)ethyl]-4-(4-cyano-2-pyridinyl)-1-piperazinecarboxamide IUPAC Name: N-[2-(4-tert-butyl-2,6-dimethylphenyl)ethyl]-4-(4-cyanopyridin-2-yl)piperazine-1-carboxamide Traditional Name: N-[2-(4-tert-butyl-2,6-dimethyl-phenyl)ethyl]-4-(4-cyano-2-pyridyl)piperazine-1-carboxamide Formula: C25H33N5O MolecularWeight: 419.56242

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1CCNC(=O)N2CCN(CC2)C3=NC=CC(=C3)C#N)C)C(C)(C)C

Isomeric SMILES

CC1=CC(=CC(=C1CCNC(=O)N2CCN(CC2)C3=NC=CC(=C3)C#N)C)C(C)(C)C

InChI

InChI=1S/C25H33N5O/c1-18-14-21(25(3,4)5)15-19(2)22(18)7-9-28-24(31)30-12-10-29(11-13-30)23-16-20(17-26)6-8-27-23/h6,8,14-16H,7,9-13H2,1-5H3,(H,28,31)