(4-nitrophenyl) N-[1-[[3-methyl-1-(2-methylsulfanylethylamino)-1-oxidanylidene-butan-2-yl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]carbamate

Systemtic Name: (4-nitrophenyl) N-[1-[[3-methyl-1-(2-methylsulfanylethylamino)-1-oxidanylidene-butan-2-yl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]carbamate Openeye Name: (4-nitrophenyl) N-[1-benzyl-2-[[2-methyl-1-(2-methylsulfanylethylcarbamoyl)propyl]amino]-2-oxo-ethyl]carbamate CAS Name: N-[1-[[3-methyl-1-[2-(methylthio)ethylamino]-1-oxobutan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]carbamic acid (4-nitrophenyl) ester IUPAC Name: (4-nitrophenyl) N-[1-[[3-methyl-1-(2-methylsulfanylethylamino)-1-oxobutan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]carbamate Traditional Name: N-[1-benzyl-2-keto-2-[[2-methyl-1-[2-(methylthio)ethylcarbamoyl]propyl]amino]ethyl]carbamic acid (4-nitrophenyl) ester Formula: C24H30N4O6S MolecularWeight: 502.5832

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NCCSC)NC(=O)C(CC1=CC=CC=C1)NC(=O)OC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)C(C(=O)NCCSC)NC(=O)C(CC1=CC=CC=C1)NC(=O)OC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C24H30N4O6S/c1-16(2)21(23(30)25-13-14-35-3)27-22(29)20(15-17-7-5-4-6-8-17)26-24(31)34-19-11-9-18(10-12-19)28(32)33/h4-12,16,20-21H,13-15H2,1-3H3,(H,25,30)(H,26,31)(H,27,29)