methyl (2R)-2-[[4-(butan-2-ylsulfamoyl)phenyl]carbonylamino]-3-(1H-indol-3-yl)propanoate

Systemtic Name: methyl (2R)-2-[[4-(butan-2-ylsulfamoyl)phenyl]carbonylamino]-3-(1H-indol-3-yl)propanoate Openeye Name: methyl (2R)-3-(1H-indol-3-yl)-2-[[4-(sec-butylsulfamoyl)benzoyl]amino]propanoate CAS Name: (2R)-2-[[[4-(butan-2-ylsulfamoyl)phenyl]-oxomethyl]amino]-3-(1H-indol-3-yl)propanoic acid methyl ester IUPAC Name: methyl (2R)-2-[[4-(butan-2-ylsulfamoyl)benzoyl]amino]-3-(1H-indol-3-yl)propanoate Traditional Name: (2R)-3-(1H-indol-3-yl)-2-[[4-(sec-butylsulfamoyl)benzoyl]amino]propionic acid methyl ester Formula: C23H27N3O5S MolecularWeight: 457.54258

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NS(=O)(=O)C1=CC=C(C=C1)C(=O)NC(CC2=CNC3=CC=CC=C32)C(=O)OC

Isomeric SMILES

CCC(C)NS(=O)(=O)C1=CC=C(C=C1)C(=O)N[C@H](CC2=CNC3=CC=CC=C32)C(=O)OC

InChI

InChI=1S/C23H27N3O5S/c1-4-15(2)26-32(29,30)18-11-9-16(10-12-18)22(27)25-21(23(28)31-3)13-17-14-24-20-8-6-5-7-19(17)20/h5-12,14-15,21,24,26H,4,13H2,1-3H3,(H,25,27)/t15?,21-/m1/s1