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

Systemtic Name: 4-[6-ethyl-5-[(3-methylphenyl)methyl]-2-phenyl-pyrimidin-4-yl]-N,N-dimethyl-piperazine-1-carboxamide Openeye Name: 4-[6-ethyl-5-(m-tolylmethyl)-2-phenyl-pyrimidin-4-yl]-N,N-dimethyl-piperazine-1-carboxamide CAS Name: 4-[6-ethyl-5-[(3-methylphenyl)methyl]-2-phenyl-4-pyrimidinyl]-N,N-dimethyl-1-piperazinecarboxamide IUPAC Name: 4-[6-ethyl-5-[(3-methylphenyl)methyl]-2-phenylpyrimidin-4-yl]-N,N-dimethylpiperazine-1-carboxamide Traditional Name: 4-[6-ethyl-5-(3-methylbenzyl)-2-phenyl-pyrimidin-4-yl]-N,N-dimethyl-piperazine-1-carboxamide Formula: C27H33N5O MolecularWeight: 443.58382

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NC(=N1)C2=CC=CC=C2)N3CCN(CC3)C(=O)N(C)C)CC4=CC=CC(=C4)C

Isomeric SMILES

CCC1=C(C(=NC(=N1)C2=CC=CC=C2)N3CCN(CC3)C(=O)N(C)C)CC4=CC=CC(=C4)C

InChI

InChI=1S/C27H33N5O/c1-5-24-23(19-21-11-9-10-20(2)18-21)26(29-25(28-24)22-12-7-6-8-13-22)31-14-16-32(17-15-31)27(33)30(3)4/h6-13,18H,5,14-17,19H2,1-4H3