N'-[2-(4-chlorophenyl)-2-thiophen-2-ylsulfonyl-ethyl]-N-(3-imidazol-1-ylpropyl)ethanediamide

Systemtic Name: N'-[2-(4-chlorophenyl)-2-thiophen-2-ylsulfonyl-ethyl]-N-(3-imidazol-1-ylpropyl)ethanediamide Openeye Name: N'-[2-(4-chlorophenyl)-2-(2-thienylsulfonyl)ethyl]-N-(3-imidazol-1-ylpropyl)oxamide CAS Name: N'-[2-(4-chlorophenyl)-2-thiophen-2-ylsulfonylethyl]-N-[3-(1-imidazolyl)propyl]oxamide IUPAC Name: N'-[2-(4-chlorophenyl)-2-thiophen-2-ylsulfonylethyl]-N-(3-imidazol-1-ylpropyl)oxamide Traditional Name: N'-[2-(4-chlorophenyl)-2-(2-thienylsulfonyl)ethyl]-N-(3-imidazol-1-ylpropyl)oxamide Formula: C20H21ClN4O4S2 MolecularWeight: 480.98814

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)S(=O)(=O)C(CNC(=O)C(=O)NCCCN2C=CN=C2)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CSC(=C1)S(=O)(=O)C(CNC(=O)C(=O)NCCCN2C=CN=C2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H21ClN4O4S2/c21-16-6-4-15(5-7-16)17(31(28,29)18-3-1-12-30-18)13-24-20(27)19(26)23-8-2-10-25-11-9-22-14-25/h1,3-7,9,11-12,14,17H,2,8,10,13H2,(H,23,26)(H,24,27)