N-[5-[(3-chloranyl-4-methyl-phenyl)methyl]-1,3-thiazol-2-yl]-4-(2-cyanoethylsulfamoyl)benzamide

Systemtic Name: N-[5-[(3-chloranyl-4-methyl-phenyl)methyl]-1,3-thiazol-2-yl]-4-(2-cyanoethylsulfamoyl)benzamide Openeye Name: N-[5-[(3-chloro-4-methyl-phenyl)methyl]thiazol-2-yl]-4-(2-cyanoethylsulfamoyl)benzamide CAS Name: N-[5-[(3-chloro-4-methylphenyl)methyl]-2-thiazolyl]-4-(2-cyanoethylsulfamoyl)benzamide IUPAC Name: N-[5-[(3-chloro-4-methylphenyl)methyl]-1,3-thiazol-2-yl]-4-(2-cyanoethylsulfamoyl)benzamide Traditional Name: N-[5-(3-chloro-4-methyl-benzyl)thiazol-2-yl]-4-(2-cyanoethylsulfamoyl)benzamide Formula: C21H19ClN4O3S2 MolecularWeight: 474.98356

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CC2=CN=C(S2)NC(=O)C3=CC=C(C=C3)S(=O)(=O)NCCC#N)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)CC2=CN=C(S2)NC(=O)C3=CC=C(C=C3)S(=O)(=O)NCCC#N)Cl

InChI

InChI=1S/C21H19ClN4O3S2/c1-14-3-4-15(12-19(14)22)11-17-13-24-21(30-17)26-20(27)16-5-7-18(8-6-16)31(28,29)25-10-2-9-23/h3-8,12-13,25H,2,10-11H2,1H3,(H,24,26,27)