N-(4-tert-butylphenyl)-4-[3-(dimethylamino)pyridin-2-yl]-2-methyl-piperazine-1-carboxamide

Systemtic Name: N-(4-tert-butylphenyl)-4-[3-(dimethylamino)pyridin-2-yl]-2-methyl-piperazine-1-carboxamide Openeye Name: N-(4-tert-butylphenyl)-4-[3-(dimethylamino)-2-pyridyl]-2-methyl-piperazine-1-carboxamide CAS Name: N-(4-tert-butylphenyl)-4-[3-(dimethylamino)-2-pyridinyl]-2-methyl-1-piperazinecarboxamide IUPAC Name: N-(4-tert-butylphenyl)-4-[3-(dimethylamino)pyridin-2-yl]-2-methylpiperazine-1-carboxamide Traditional Name: N-(4-tert-butylphenyl)-4-[3-(dimethylamino)-2-pyridyl]-2-methyl-piperazine-1-carboxamide Formula: C23H33N5O MolecularWeight: 395.54102

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(=O)NC2=CC=C(C=C2)C(C)(C)C)C3=C(C=CC=N3)N(C)C

Isomeric SMILES

CC1CN(CCN1C(=O)NC2=CC=C(C=C2)C(C)(C)C)C3=C(C=CC=N3)N(C)C

InChI

InChI=1S/C23H33N5O/c1-17-16-27(21-20(26(5)6)8-7-13-24-21)14-15-28(17)22(29)25-19-11-9-18(10-12-19)23(2,3)4/h7-13,17H,14-16H2,1-6H3,(H,25,29)