4-[bis(2-cyanoethyl)sulfamoyl]-N-[4-(4-nitrothiophen-2-yl)-1,3-thiazol-2-yl]benzamide

Systemtic Name: 4-[bis(2-cyanoethyl)sulfamoyl]-N-[4-(4-nitrothiophen-2-yl)-1,3-thiazol-2-yl]benzamide Openeye Name: 4-[bis(2-cyanoethyl)sulfamoyl]-N-[4-(4-nitro-2-thienyl)thiazol-2-yl]benzamide CAS Name: 4-[bis(2-cyanoethyl)sulfamoyl]-N-[4-(4-nitro-2-thiophenyl)-2-thiazolyl]benzamide IUPAC Name: 4-[bis(2-cyanoethyl)sulfamoyl]-N-[4-(4-nitrothiophen-2-yl)-1,3-thiazol-2-yl]benzamide Traditional Name: 4-[bis(2-cyanoethyl)sulfamoyl]-N-[4-(4-nitro-2-thienyl)thiazol-2-yl]benzamide Formula: C20H16N6O5S3 MolecularWeight: 516.57324

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NC2=NC(=CS2)C3=CC(=CS3)[N+](=O)[O-])S(=O)(=O)N(CCC#N)CCC#N

Isomeric SMILES

C1=CC(=CC=C1C(=O)NC2=NC(=CS2)C3=CC(=CS3)[N+](=O)[O-])S(=O)(=O)N(CCC#N)CCC#N

InChI

InChI=1S/C20H16N6O5S3/c21-7-1-9-25(10-2-8-22)34(30,31)16-5-3-14(4-6-16)19(27)24-20-23-17(13-33-20)18-11-15(12-32-18)26(28)29/h3-6,11-13H,1-2,9-10H2,(H,23,24,27)