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

Systemtic Name: 4-[2,6-dimethyl-5-[(3-methylphenyl)methyl]pyrimidin-4-yl]-N-ethyl-piperazine-1-carboxamide Openeye Name: 4-[2,6-dimethyl-5-(m-tolylmethyl)pyrimidin-4-yl]-N-ethyl-piperazine-1-carboxamide CAS Name: 4-[2,6-dimethyl-5-[(3-methylphenyl)methyl]-4-pyrimidinyl]-N-ethyl-1-piperazinecarboxamide IUPAC Name: 4-[2,6-dimethyl-5-[(3-methylphenyl)methyl]pyrimidin-4-yl]-N-ethylpiperazine-1-carboxamide Traditional Name: 4-[2,6-dimethyl-5-(3-methylbenzyl)pyrimidin-4-yl]-N-ethyl-piperazine-1-carboxamide Formula: C21H29N5O MolecularWeight: 367.48786

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)N1CCN(CC1)C2=NC(=NC(=C2CC3=CC=CC(=C3)C)C)C

Isomeric SMILES

CCNC(=O)N1CCN(CC1)C2=NC(=NC(=C2CC3=CC=CC(=C3)C)C)C

InChI

InChI=1S/C21H29N5O/c1-5-22-21(27)26-11-9-25(10-12-26)20-19(16(3)23-17(4)24-20)14-18-8-6-7-15(2)13-18/h6-8,13H,5,9-12,14H2,1-4H3,(H,22,27)