ethyl 2-[[4-[bis(2-cyanoethyl)sulfamoyl]phenyl]carbonylamino]-1,3-thiazole-4-carboxylate

Systemtic Name: ethyl 2-[[4-[bis(2-cyanoethyl)sulfamoyl]phenyl]carbonylamino]-1,3-thiazole-4-carboxylate Openeye Name: ethyl 2-[[4-[bis(2-cyanoethyl)sulfamoyl]benzoyl]amino]thiazole-4-carboxylate CAS Name: 2-[[[4-[bis(2-cyanoethyl)sulfamoyl]phenyl]-oxomethyl]amino]-4-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[4-[bis(2-cyanoethyl)sulfamoyl]benzoyl]amino]-1,3-thiazole-4-carboxylate Traditional Name: 2-[[4-[bis(2-cyanoethyl)sulfamoyl]benzoyl]amino]thiazole-4-carboxylic acid ethyl ester Formula: C19H19N5O5S2 MolecularWeight: 461.51466

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CSC(=N1)NC(=O)C2=CC=C(C=C2)S(=O)(=O)N(CCC#N)CCC#N

Isomeric SMILES

CCOC(=O)C1=CSC(=N1)NC(=O)C2=CC=C(C=C2)S(=O)(=O)N(CCC#N)CCC#N

InChI

InChI=1S/C19H19N5O5S2/c1-2-29-18(26)16-13-30-19(22-16)23-17(25)14-5-7-15(8-6-14)31(27,28)24(11-3-9-20)12-4-10-21/h5-8,13H,2-4,11-12H2,1H3,(H,22,23,25)