(4R)-5-[2-[(4-bromanyl-2-methyl-phenyl)amino]ethanoyl]-4-methyl-3,4-dihydro-1H-1,5-benzodiazepin-2-one

Systemtic Name: (4R)-5-[2-[(4-bromanyl-2-methyl-phenyl)amino]ethanoyl]-4-methyl-3,4-dihydro-1H-1,5-benzodiazepin-2-one Openeye Name: (4R)-5-[2-(4-bromo-2-methyl-anilino)acetyl]-4-methyl-3,4-dihydro-1H-1,5-benzodiazepin-2-one CAS Name: (4R)-5-[2-(4-bromo-2-methylanilino)-1-oxoethyl]-4-methyl-3,4-dihydro-1H-1,5-benzodiazepin-2-one IUPAC Name: (4R)-5-[2-(4-bromo-2-methylanilino)acetyl]-4-methyl-3,4-dihydro-1H-1,5-benzodiazepin-2-one Traditional Name: (4R)-5-[2-(4-bromo-2-methyl-anilino)acetyl]-4-methyl-3,4-dihydro-1H-1,5-benzodiazepin-2-one Formula: C19H20BrN3O2 MolecularWeight: 402.285

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)NC2=CC=CC=C2N1C(=O)CNC3=C(C=C(C=C3)Br)C

Isomeric SMILES

C[C@@H]1CC(=O)NC2=CC=CC=C2N1C(=O)CNC3=C(C=C(C=C3)Br)C

InChI

InChI=1S/C19H20BrN3O2/c1-12-9-14(20)7-8-15(12)21-11-19(25)23-13(2)10-18(24)22-16-5-3-4-6-17(16)23/h3-9,13,21H,10-11H2,1-2H3,(H,22,24)/t13-/m1/s1