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

Systemtic Name: 4-[6-ethyl-2-methyl-5-[(4-methylphenyl)methyl]pyrimidin-4-yl]-N-(2-methoxyphenyl)-1,4-diazepane-1-carboxamide Openeye Name: 4-[6-ethyl-2-methyl-5-(p-tolylmethyl)pyrimidin-4-yl]-N-(2-methoxyphenyl)-1,4-diazepane-1-carboxamide CAS Name: 4-[6-ethyl-2-methyl-5-[(4-methylphenyl)methyl]-4-pyrimidinyl]-N-(2-methoxyphenyl)-1,4-diazepane-1-carboxamide IUPAC Name: 4-[6-ethyl-2-methyl-5-[(4-methylphenyl)methyl]pyrimidin-4-yl]-N-(2-methoxyphenyl)-1,4-diazepane-1-carboxamide Traditional Name: 4-[6-ethyl-2-methyl-5-(4-methylbenzyl)pyrimidin-4-yl]-N-(2-methoxyphenyl)-1,4-diazepane-1-carboxamide Formula: C28H35N5O2 MolecularWeight: 473.6098

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NC(=N1)C)N2CCCN(CC2)C(=O)NC3=CC=CC=C3OC)CC4=CC=C(C=C4)C

Isomeric SMILES

CCC1=C(C(=NC(=N1)C)N2CCCN(CC2)C(=O)NC3=CC=CC=C3OC)CC4=CC=C(C=C4)C

InChI

InChI=1S/C28H35N5O2/c1-5-24-23(19-22-13-11-20(2)12-14-22)27(30-21(3)29-24)32-15-8-16-33(18-17-32)28(34)31-25-9-6-7-10-26(25)35-4/h6-7,9-14H,5,8,15-19H2,1-4H3,(H,31,34)