(phenylmethyl) N-[4-[(4-methyl-1-oxidanyl-pentan-2-yl)amino]-1-(4-methylsulfonylphenyl)-3-oxidanyl-4-oxidanylidene-butan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[4-[(4-methyl-1-oxidanyl-pentan-2-yl)amino]-1-(4-methylsulfonylphenyl)-3-oxidanyl-4-oxidanylidene-butan-2-yl]carbamate Openeye Name: benzyl N-[2-hydroxy-3-[[1-(hydroxymethyl)-3-methyl-butyl]amino]-1-[(4-methylsulfonylphenyl)methyl]-3-oxo-propyl]carbamate CAS Name: N-[3-hydroxy-4-[(1-hydroxy-4-methylpentan-2-yl)amino]-1-(4-methylsulfonylphenyl)-4-oxobutan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[3-hydroxy-4-[(1-hydroxy-4-methylpentan-2-yl)amino]-1-(4-methylsulfonylphenyl)-4-oxobutan-2-yl]carbamate Traditional Name: N-[2-hydroxy-3-keto-1-(4-mesylbenzyl)-3-[(3-methyl-1-methylol-butyl)amino]propyl]carbamic acid benzyl ester Formula: C25H34N2O7S MolecularWeight: 506.61166

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(CO)NC(=O)C(C(CC1=CC=C(C=C1)S(=O)(=O)C)NC(=O)OCC2=CC=CC=C2)O

Isomeric SMILES

CC(C)CC(CO)NC(=O)C(C(CC1=CC=C(C=C1)S(=O)(=O)C)NC(=O)OCC2=CC=CC=C2)O

InChI

InChI=1S/C25H34N2O7S/c1-17(2)13-20(15-28)26-24(30)23(29)22(14-18-9-11-21(12-10-18)35(3,32)33)27-25(31)34-16-19-7-5-4-6-8-19/h4-12,17,20,22-23,28-29H,13-16H2,1-3H3,(H,26,30)(H,27,31)