3-azanyl-N-[(2S)-1-[[(2S)-1-[(3-bromophenyl)methylamino]-1-oxidanylidene-propan-2-yl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]benzamide

Systemtic Name: 3-azanyl-N-[(2S)-1-[[(2S)-1-[(3-bromophenyl)methylamino]-1-oxidanylidene-propan-2-yl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]benzamide Openeye Name: 3-amino-N-[(1S)-1-benzyl-2-[[(1S)-2-[(3-bromophenyl)methylamino]-1-methyl-2-oxo-ethyl]amino]-2-oxo-ethyl]benzamide CAS Name: 3-amino-N-[(2S)-1-[[(2S)-1-[(3-bromophenyl)methylamino]-1-oxopropan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]benzamide IUPAC Name: 3-amino-N-[(2S)-1-[[(2S)-1-[(3-bromophenyl)methylamino]-1-oxopropan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]benzamide Traditional Name: 3-amino-N-[(1S)-1-benzyl-2-[[(1S)-2-[(3-bromobenzyl)amino]-2-keto-1-methyl-ethyl]amino]-2-keto-ethyl]benzamide Formula: C26H27BrN4O3 MolecularWeight: 523.42158

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC(=CC=C1)Br)NC(=O)C(CC2=CC=CC=C2)NC(=O)C3=CC(=CC=C3)N

Isomeric SMILES

C[C@@H](C(=O)NCC1=CC(=CC=C1)Br)NC(=O)[C@H](CC2=CC=CC=C2)NC(=O)C3=CC(=CC=C3)N

InChI

InChI=1S/C26H27BrN4O3/c1-17(24(32)29-16-19-9-5-11-21(27)13-19)30-26(34)23(14-18-7-3-2-4-8-18)31-25(33)20-10-6-12-22(28)15-20/h2-13,15,17,23H,14,16,28H2,1H3,(H,29,32)(H,30,34)(H,31,33)/t17-,23-/m0/s1