methyl 3-[3-[4-(diethylsulfamoyl)phenyl]propanoylamino]-3-thiophen-2-yl-propanoate

Systemtic Name: methyl 3-[3-[4-(diethylsulfamoyl)phenyl]propanoylamino]-3-thiophen-2-yl-propanoate Openeye Name: methyl 3-[3-[4-(diethylsulfamoyl)phenyl]propanoylamino]-3-(2-thienyl)propanoate CAS Name: 3-[[3-[4-(diethylsulfamoyl)phenyl]-1-oxopropyl]amino]-3-thiophen-2-ylpropanoic acid methyl ester IUPAC Name: methyl 3-[3-[4-(diethylsulfamoyl)phenyl]propanoylamino]-3-thiophen-2-ylpropanoate Traditional Name: 3-[3-[4-(diethylsulfamoyl)phenyl]propanoylamino]-3-(2-thienyl)propionic acid methyl ester Formula: C21H28N2O5S2 MolecularWeight: 452.58742

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)CCC(=O)NC(CC(=O)OC)C2=CC=CS2

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)CCC(=O)NC(CC(=O)OC)C2=CC=CS2

InChI

InChI=1S/C21H28N2O5S2/c1-4-23(5-2)30(26,27)17-11-8-16(9-12-17)10-13-20(24)22-18(15-21(25)28-3)19-7-6-14-29-19/h6-9,11-12,14,18H,4-5,10,13,15H2,1-3H3,(H,22,24)