3-(4-propan-2-ylphenyl)-N-[[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]carbamothioyl]prop-2-enamide

Systemtic Name: 3-(4-propan-2-ylphenyl)-N-[[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]carbamothioyl]prop-2-enamide Openeye Name: 3-(4-isopropylphenyl)-N-[[4-(thiazol-2-ylsulfamoyl)phenyl]carbamothioyl]prop-2-enamide CAS Name: 3-(4-propan-2-ylphenyl)-N-[sulfanylidene-[4-(2-thiazolylsulfamoyl)anilino]methyl]-2-propenamide IUPAC Name: 3-(4-propan-2-ylphenyl)-N-[[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]carbamothioyl]prop-2-enamide Traditional Name: 3-p-cumenyl-N-[[4-(thiazol-2-ylsulfamoyl)phenyl]thiocarbamoyl]acrylamide Formula: C22H22N4O3S3 MolecularWeight: 486.63008

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C=CC(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=CS3

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C=CC(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=CS3

InChI

InChI=1S/C22H22N4O3S3/c1-15(2)17-6-3-16(4-7-17)5-12-20(27)25-21(30)24-18-8-10-19(11-9-18)32(28,29)26-22-23-13-14-31-22/h3-15H,1-2H3,(H,23,26)(H2,24,25,27,30)