N-[3-[[(3-azanyl-2,2-dimethyl-propyl)-(4-cyanophenyl)carbonyl-amino]methyl]phenyl]-2-bromanyl-benzamide

Systemtic Name: N-[3-[[(3-azanyl-2,2-dimethyl-propyl)-(4-cyanophenyl)carbonyl-amino]methyl]phenyl]-2-bromanyl-benzamide Openeye Name: N-[3-[[(3-amino-2,2-dimethyl-propyl)-(4-cyanobenzoyl)amino]methyl]phenyl]-2-bromo-benzamide CAS Name: N-[3-[[(3-amino-2,2-dimethylpropyl)-[(4-cyanophenyl)-oxomethyl]amino]methyl]phenyl]-2-bromobenzamide IUPAC Name: N-[3-[[(3-amino-2,2-dimethylpropyl)-(4-cyanobenzoyl)amino]methyl]phenyl]-2-bromobenzamide Traditional Name: N-[3-[[(3-amino-2,2-dimethyl-propyl)-(4-cyanobenzoyl)amino]methyl]phenyl]-2-bromo-benzamide Formula: C27H27BrN4O2 MolecularWeight: 519.43288

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CN)CN(CC1=CC(=CC=C1)NC(=O)C2=CC=CC=C2Br)C(=O)C3=CC=C(C=C3)C#N

Isomeric SMILES

CC(C)(CN)CN(CC1=CC(=CC=C1)NC(=O)C2=CC=CC=C2Br)C(=O)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C27H27BrN4O2/c1-27(2,17-30)18-32(26(34)21-12-10-19(15-29)11-13-21)16-20-6-5-7-22(14-20)31-25(33)23-8-3-4-9-24(23)28/h3-14H,16-18,30H2,1-2H3,(H,31,33)