5,7-bis(4-bromophenyl)-2,3-dicyano-N-cyclohexyl-7-methyl-4,6-dihydro-1H-1,4-diazepine-5-carboxamide

Systemtic Name: 5,7-bis(4-bromophenyl)-2,3-dicyano-N-cyclohexyl-7-methyl-4,6-dihydro-1H-1,4-diazepine-5-carboxamide Openeye Name: 5,7-bis(4-bromophenyl)-2,3-dicyano-N-cyclohexyl-7-methyl-4,6-dihydro-1H-1,4-diazepine-5-carboxamide CAS Name: 5,7-bis(4-bromophenyl)-2,3-dicyano-N-cyclohexyl-7-methyl-4,6-dihydro-1H-1,4-diazepine-5-carboxamide IUPAC Name: 5,7-bis(4-bromophenyl)-2,3-dicyano-N-cyclohexyl-7-methyl-4,6-dihydro-1H-1,4-diazepine-5-carboxamide Traditional Name: 5,7-bis(4-bromophenyl)-2,3-dicyano-N-cyclohexyl-7-methyl-4,6-dihydro-1H-1,4-diazepine-5-carboxamide Formula: C27H27Br2N5O MolecularWeight: 597.34418

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(NC(=C(N1)C#N)C#N)(C2=CC=C(C=C2)Br)C(=O)NC3CCCCC3)C4=CC=C(C=C4)Br

Isomeric SMILES

CC1(CC(NC(=C(N1)C#N)C#N)(C2=CC=C(C=C2)Br)C(=O)NC3CCCCC3)C4=CC=C(C=C4)Br

InChI

InChI=1S/C27H27Br2N5O/c1-26(18-7-11-20(28)12-8-18)17-27(19-9-13-21(29)14-10-19,34-24(16-31)23(15-30)33-26)25(35)32-22-5-3-2-4-6-22/h7-14,22,33-34H,2-6,17H2,1H3,(H,32,35)