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

Systemtic Name: 4-[6-ethyl-2-methyl-5-[(4-methylphenyl)methyl]pyrimidin-4-yl]-N-(4-methylphenyl)-1,4-diazepane-1-carboxamide Openeye Name: 4-[6-ethyl-2-methyl-5-(p-tolylmethyl)pyrimidin-4-yl]-N-(p-tolyl)-1,4-diazepane-1-carboxamide CAS Name: 4-[6-ethyl-2-methyl-5-[(4-methylphenyl)methyl]-4-pyrimidinyl]-N-(4-methylphenyl)-1,4-diazepane-1-carboxamide IUPAC Name: 4-[6-ethyl-2-methyl-5-[(4-methylphenyl)methyl]pyrimidin-4-yl]-N-(4-methylphenyl)-1,4-diazepane-1-carboxamide Traditional Name: 4-[6-ethyl-2-methyl-5-(4-methylbenzyl)pyrimidin-4-yl]-N-(p-tolyl)-1,4-diazepane-1-carboxamide Formula: C28H35N5O MolecularWeight: 457.6104

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NC(=N1)C)N2CCCN(CC2)C(=O)NC3=CC=C(C=C3)C)CC4=CC=C(C=C4)C

Isomeric SMILES

CCC1=C(C(=NC(=N1)C)N2CCCN(CC2)C(=O)NC3=CC=C(C=C3)C)CC4=CC=C(C=C4)C

InChI

InChI=1S/C28H35N5O/c1-5-26-25(19-23-11-7-20(2)8-12-23)27(30-22(4)29-26)32-15-6-16-33(18-17-32)28(34)31-24-13-9-21(3)10-14-24/h7-14H,5-6,15-19H2,1-4H3,(H,31,34)