(phenylmethyl) N-[(2S)-3-methyl-1-[(4-methyl-3-sulfamoyl-phenyl)amino]-1-oxidanylidene-butan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[(2S)-3-methyl-1-[(4-methyl-3-sulfamoyl-phenyl)amino]-1-oxidanylidene-butan-2-yl]carbamate Openeye Name: benzyl N-[(1S)-2-methyl-1-[(4-methyl-3-sulfamoyl-phenyl)carbamoyl]propyl]carbamate CAS Name: N-[(2S)-3-methyl-1-(4-methyl-3-sulfamoylanilino)-1-oxobutan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(2S)-3-methyl-1-(4-methyl-3-sulfamoylanilino)-1-oxobutan-2-yl]carbamate Traditional Name: N-[(1S)-2-methyl-1-[(4-methyl-3-sulfamoyl-phenyl)carbamoyl]propyl]carbamic acid benzyl ester Formula: C20H25N3O5S MolecularWeight: 419.4946

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)[C@H](C(C)C)NC(=O)OCC2=CC=CC=C2)S(=O)(=O)N

InChI

InChI=1S/C20H25N3O5S/c1-13(2)18(23-20(25)28-12-15-7-5-4-6-8-15)19(24)22-16-10-9-14(3)17(11-16)29(21,26)27/h4-11,13,18H,12H2,1-3H3,(H,22,24)(H,23,25)(H2,21,26,27)/t18-/m0/s1