(3-bromanyl-2-methyl-phenyl)carbonyl-[tert-butyl-(3-methylphenyl)carbonyl-amino]cyanamide

Systemtic Name: (3-bromanyl-2-methyl-phenyl)carbonyl-[tert-butyl-(3-methylphenyl)carbonyl-amino]cyanamide Openeye Name: (3-bromo-2-methyl-benzoyl)-[tert-butyl-(3-methylbenzoyl)amino]cyanamide CAS Name: [(3-bromo-2-methylphenyl)-oxomethyl]-[tert-butyl-[(3-methylphenyl)-oxomethyl]amino]cyanamide IUPAC Name: (3-bromo-2-methylbenzoyl)-[tert-butyl-(3-methylbenzoyl)amino]cyanamide Traditional Name: (3-bromo-2-methyl-benzoyl)-[tert-butyl(m-toluoyl)amino]cyanamide Formula: C21H22BrN3O2 MolecularWeight: 428.32228

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)N(C(C)(C)C)N(C#N)C(=O)C2=C(C(=CC=C2)Br)C

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)N(C(C)(C)C)N(C#N)C(=O)C2=C(C(=CC=C2)Br)C

InChI

InChI=1S/C21H22BrN3O2/c1-14-8-6-9-16(12-14)19(26)25(21(3,4)5)24(13-23)20(27)17-10-7-11-18(22)15(17)2/h6-12H,1-5H3