N-(3-imidazol-1-ylpropyl)-N'-(2-pyridin-3-yl-2-thiophen-2-ylsulfonyl-ethyl)ethanediamide

Systemtic Name: N-(3-imidazol-1-ylpropyl)-N'-(2-pyridin-3-yl-2-thiophen-2-ylsulfonyl-ethyl)ethanediamide Openeye Name: N-(3-imidazol-1-ylpropyl)-N'-[2-(3-pyridyl)-2-(2-thienylsulfonyl)ethyl]oxamide CAS Name: N-[3-(1-imidazolyl)propyl]-N'-[2-(3-pyridinyl)-2-thiophen-2-ylsulfonylethyl]oxamide IUPAC Name: N-(3-imidazol-1-ylpropyl)-N'-(2-pyridin-3-yl-2-thiophen-2-ylsulfonylethyl)oxamide Traditional Name: N-(3-imidazol-1-ylpropyl)-N'-[2-(3-pyridyl)-2-(2-thienylsulfonyl)ethyl]oxamide Formula: C19H21N5O4S2 MolecularWeight: 447.53114

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C(CNC(=O)C(=O)NCCCN2C=CN=C2)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

C1=CC(=CN=C1)C(CNC(=O)C(=O)NCCCN2C=CN=C2)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C19H21N5O4S2/c25-18(22-7-3-9-24-10-8-21-14-24)19(26)23-13-16(15-4-1-6-20-12-15)30(27,28)17-5-2-11-29-17/h1-2,4-6,8,10-12,14,16H,3,7,9,13H2,(H,22,25)(H,23,26)