N-(4-bromanyl-2-methyl-phenyl)-2-[[2-[[(2S)-butan-2-yl]carbamoylamino]-2-oxidanylidene-ethyl]-methyl-amino]ethanamide

Systemtic Name: N-(4-bromanyl-2-methyl-phenyl)-2-[[2-[[(2S)-butan-2-yl]carbamoylamino]-2-oxidanylidene-ethyl]-methyl-amino]ethanamide Openeye Name: N-(4-bromo-2-methyl-phenyl)-2-[methyl-[2-[[(1S)-1-methylpropyl]carbamoylamino]-2-oxo-ethyl]amino]acetamide CAS Name: N-(4-bromo-2-methylphenyl)-2-[[2-[[[[(2S)-butan-2-yl]amino]-oxomethyl]amino]-2-oxoethyl]-methylamino]acetamide IUPAC Name: N-(4-bromo-2-methylphenyl)-2-[[2-[[(2S)-butan-2-yl]carbamoylamino]-2-oxoethyl]-methylamino]acetamide Traditional Name: N-(4-bromo-2-methyl-phenyl)-2-[[2-keto-2-[[(1S)-1-methylpropyl]carbamoylamino]ethyl]-methyl-amino]acetamide Formula: C17H25BrN4O3 MolecularWeight: 413.3094

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)NC(=O)CN(C)CC(=O)NC1=C(C=C(C=C1)Br)C

Isomeric SMILES

CC[C@H](C)NC(=O)NC(=O)CN(C)CC(=O)NC1=C(C=C(C=C1)Br)C

InChI

InChI=1S/C17H25BrN4O3/c1-5-12(3)19-17(25)21-16(24)10-22(4)9-15(23)20-14-7-6-13(18)8-11(14)2/h6-8,12H,5,9-10H2,1-4H3,(H,20,23)(H2,19,21,24,25)/t12-/m0/s1