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

Systemtic Name: 4-[6-ethyl-2-methyl-5-[(4-methylphenyl)methyl]pyrimidin-4-yl]-N-naphthalen-1-yl-1,4-diazepane-1-carboxamide Openeye Name: 4-[6-ethyl-2-methyl-5-(p-tolylmethyl)pyrimidin-4-yl]-N-(1-naphthyl)-1,4-diazepane-1-carboxamide CAS Name: 4-[6-ethyl-2-methyl-5-[(4-methylphenyl)methyl]-4-pyrimidinyl]-N-(1-naphthalenyl)-1,4-diazepane-1-carboxamide IUPAC Name: 4-[6-ethyl-2-methyl-5-[(4-methylphenyl)methyl]pyrimidin-4-yl]-N-naphthalen-1-yl-1,4-diazepane-1-carboxamide Traditional Name: 4-[6-ethyl-2-methyl-5-(4-methylbenzyl)pyrimidin-4-yl]-N-(1-naphthyl)-1,4-diazepane-1-carboxamide Formula: C31H35N5O MolecularWeight: 493.6425

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NC(=N1)C)N2CCCN(CC2)C(=O)NC3=CC=CC4=CC=CC=C43)CC5=CC=C(C=C5)C

Isomeric SMILES

CCC1=C(C(=NC(=N1)C)N2CCCN(CC2)C(=O)NC3=CC=CC4=CC=CC=C43)CC5=CC=C(C=C5)C

InChI

InChI=1S/C31H35N5O/c1-4-28-27(21-24-15-13-22(2)14-16-24)30(33-23(3)32-28)35-17-8-18-36(20-19-35)31(37)34-29-12-7-10-25-9-5-6-11-26(25)29/h5-7,9-16H,4,8,17-21H2,1-3H3,(H,34,37)