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

Systemtic Name: N-(4-bromophenyl)-4-[5-[(4-methoxyphenyl)methyl]-2,6-dimethyl-pyrimidin-4-yl]-1,4-diazepane-1-carboxamide Openeye Name: N-(4-bromophenyl)-4-[5-[(4-methoxyphenyl)methyl]-2,6-dimethyl-pyrimidin-4-yl]-1,4-diazepane-1-carboxamide CAS Name: N-(4-bromophenyl)-4-[5-[(4-methoxyphenyl)methyl]-2,6-dimethyl-4-pyrimidinyl]-1,4-diazepane-1-carboxamide IUPAC Name: N-(4-bromophenyl)-4-[5-[(4-methoxyphenyl)methyl]-2,6-dimethylpyrimidin-4-yl]-1,4-diazepane-1-carboxamide Traditional Name: N-(4-bromophenyl)-4-(2,6-dimethyl-5-p-anisyl-pyrimidin-4-yl)-1,4-diazepane-1-carboxamide Formula: C26H30BrN5O2 MolecularWeight: 524.4527

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)C)N2CCCN(CC2)C(=O)NC3=CC=C(C=C3)Br)CC4=CC=C(C=C4)OC

Isomeric SMILES

CC1=C(C(=NC(=N1)C)N2CCCN(CC2)C(=O)NC3=CC=C(C=C3)Br)CC4=CC=C(C=C4)OC

InChI

InChI=1S/C26H30BrN5O2/c1-18-24(17-20-5-11-23(34-3)12-6-20)25(29-19(2)28-18)31-13-4-14-32(16-15-31)26(33)30-22-9-7-21(27)8-10-22/h5-12H,4,13-17H2,1-3H3,(H,30,33)