tert-butyl N-[[4-[(2-methyl-5-methylsulfonyl-phenyl)carbamoyl]phenyl]methyl]carbamate

Systemtic Name: tert-butyl N-[[4-[(2-methyl-5-methylsulfonyl-phenyl)carbamoyl]phenyl]methyl]carbamate Openeye Name: tert-butyl N-[[4-[(2-methyl-5-methylsulfonyl-phenyl)carbamoyl]phenyl]methyl]carbamate CAS Name: N-[[4-[(2-methyl-5-methylsulfonylanilino)-oxomethyl]phenyl]methyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[[4-[(2-methyl-5-methylsulfonylphenyl)carbamoyl]phenyl]methyl]carbamate Traditional Name: N-[4-[(5-mesyl-2-methyl-phenyl)carbamoyl]benzyl]carbamic acid tert-butyl ester Formula: C21H26N2O5S MolecularWeight: 418.50654

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)C)NC(=O)C2=CC=C(C=C2)CNC(=O)OC(C)(C)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)C)NC(=O)C2=CC=C(C=C2)CNC(=O)OC(C)(C)C

InChI

InChI=1S/C21H26N2O5S/c1-14-6-11-17(29(5,26)27)12-18(14)23-19(24)16-9-7-15(8-10-16)13-22-20(25)28-21(2,3)4/h6-12H,13H2,1-5H3,(H,22,25)(H,23,24)