ethyl 1-[4-(ethylcarbamothioylsulfamoyl)phenyl]-5-[(E)-1-phenylprop-1-en-2-yl]pyrazole-3-carboxylate

Systemtic Name: ethyl 1-[4-(ethylcarbamothioylsulfamoyl)phenyl]-5-[(E)-1-phenylprop-1-en-2-yl]pyrazole-3-carboxylate Openeye Name: ethyl 1-[4-(ethylcarbamothioylsulfamoyl)phenyl]-5-[(E)-1-methyl-2-phenyl-vinyl]pyrazole-3-carboxylate CAS Name: 1-[4-[[ethylamino(sulfanylidene)methyl]sulfamoyl]phenyl]-5-[(E)-1-phenylprop-1-en-2-yl]-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[4-(ethylcarbamothioylsulfamoyl)phenyl]-5-[(E)-1-phenylprop-1-en-2-yl]pyrazole-3-carboxylate Traditional Name: 1-[4-(ethylthiocarbamoylsulfamoyl)phenyl]-5-[(E)-1-methyl-2-phenyl-vinyl]pyrazole-3-carboxylic acid ethyl ester Formula: C24H26N4O4S2 MolecularWeight: 498.61764

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)NS(=O)(=O)C1=CC=C(C=C1)N2C(=CC(=N2)C(=O)OCC)C(=CC3=CC=CC=C3)C

Isomeric SMILES

CCNC(=S)NS(=O)(=O)C1=CC=C(C=C1)N2C(=CC(=N2)C(=O)OCC)/C(=C/C3=CC=CC=C3)/C

InChI

InChI=1S/C24H26N4O4S2/c1-4-25-24(33)27-34(30,31)20-13-11-19(12-14-20)28-22(16-21(26-28)23(29)32-5-2)17(3)15-18-9-7-6-8-10-18/h6-16H,4-5H2,1-3H3,(H2,25,27,33)/b17-15+