ethyl 4-[[3-phenyl-2-(thiophen-2-ylsulfonylamino)propanoyl]amino]benzoate

Systemtic Name: ethyl 4-[[3-phenyl-2-(thiophen-2-ylsulfonylamino)propanoyl]amino]benzoate Openeye Name: ethyl 4-[[3-phenyl-2-(2-thienylsulfonylamino)propanoyl]amino]benzoate CAS Name: 4-[[1-oxo-3-phenyl-2-(thiophen-2-ylsulfonylamino)propyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[3-phenyl-2-(thiophen-2-ylsulfonylamino)propanoyl]amino]benzoate Traditional Name: 4-[[3-phenyl-2-(2-thienylsulfonylamino)propanoyl]amino]benzoic acid ethyl ester Formula: C22H22N2O5S2 MolecularWeight: 458.55048

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)C(CC2=CC=CC=C2)NS(=O)(=O)C3=CC=CS3

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)C(CC2=CC=CC=C2)NS(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C22H22N2O5S2/c1-2-29-22(26)17-10-12-18(13-11-17)23-21(25)19(15-16-7-4-3-5-8-16)24-31(27,28)20-9-6-14-30-20/h3-14,19,24H,2,15H2,1H3,(H,23,25)