N-tert-butyl-4-[5,6-dimethyl-2-(3-methylphenyl)pyrimidin-4-yl]piperazine-1-carboxamide

Systemtic Name: N-tert-butyl-4-[5,6-dimethyl-2-(3-methylphenyl)pyrimidin-4-yl]piperazine-1-carboxamide Openeye Name: N-tert-butyl-4-[5,6-dimethyl-2-(m-tolyl)pyrimidin-4-yl]piperazine-1-carboxamide CAS Name: N-tert-butyl-4-[5,6-dimethyl-2-(3-methylphenyl)-4-pyrimidinyl]-1-piperazinecarboxamide IUPAC Name: N-tert-butyl-4-[5,6-dimethyl-2-(3-methylphenyl)pyrimidin-4-yl]piperazine-1-carboxamide Traditional Name: N-tert-butyl-4-[5,6-dimethyl-2-(m-tolyl)pyrimidin-4-yl]piperazine-1-carboxamide Formula: C22H31N5O MolecularWeight: 381.51444

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NC(=C(C(=N2)N3CCN(CC3)C(=O)NC(C)(C)C)C)C

Isomeric SMILES

CC1=CC=CC(=C1)C2=NC(=C(C(=N2)N3CCN(CC3)C(=O)NC(C)(C)C)C)C

InChI

InChI=1S/C22H31N5O/c1-15-8-7-9-18(14-15)19-23-17(3)16(2)20(24-19)26-10-12-27(13-11-26)21(28)25-22(4,5)6/h7-9,14H,10-13H2,1-6H3,(H,25,28)