3-bromanyl-N-[(2S)-1-[2-[(4-methoxyphenyl)amino]ethylamino]-1-oxidanylidene-3-phenyl-propan-2-yl]-4-methyl-benzamide

Systemtic Name: 3-bromanyl-N-[(2S)-1-[2-[(4-methoxyphenyl)amino]ethylamino]-1-oxidanylidene-3-phenyl-propan-2-yl]-4-methyl-benzamide Openeye Name: N-[(1S)-1-benzyl-2-[2-(4-methoxyanilino)ethylamino]-2-oxo-ethyl]-3-bromo-4-methyl-benzamide CAS Name: 3-bromo-N-[(2S)-1-[2-(4-methoxyanilino)ethylamino]-1-oxo-3-phenylpropan-2-yl]-4-methylbenzamide IUPAC Name: 3-bromo-N-[(2S)-1-[2-(4-methoxyanilino)ethylamino]-1-oxo-3-phenylpropan-2-yl]-4-methylbenzamide Traditional Name: N-[(1S)-1-benzyl-2-keto-2-[2-(p-anisidino)ethylamino]ethyl]-3-bromo-4-methyl-benzamide Formula: C26H28BrN3O3 MolecularWeight: 510.42282

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC(CC2=CC=CC=C2)C(=O)NCCNC3=CC=C(C=C3)OC)Br

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)NCCNC3=CC=C(C=C3)OC)Br

InChI

InChI=1S/C26H28BrN3O3/c1-18-8-9-20(17-23(18)27)25(31)30-24(16-19-6-4-3-5-7-19)26(32)29-15-14-28-21-10-12-22(33-2)13-11-21/h3-13,17,24,28H,14-16H2,1-2H3,(H,29,32)(H,30,31)/t24-/m0/s1