4-[(5-chloranyl-2-methyl-phenyl)-methylsulfonyl-amino]-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]butanamide

Systemtic Name: 4-[(5-chloranyl-2-methyl-phenyl)-methylsulfonyl-amino]-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]butanamide Openeye Name: 4-(5-chloro-2-methyl-N-methylsulfonyl-anilino)-N-[4-(thiazol-2-ylsulfamoyl)phenyl]butanamide CAS Name: 4-(5-chloro-2-methyl-N-methylsulfonylanilino)-N-[4-(2-thiazolylsulfamoyl)phenyl]butanamide IUPAC Name: 4-(5-chloro-2-methyl-N-methylsulfonylanilino)-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]butanamide Traditional Name: 4-(5-chloro-N-mesyl-2-methyl-anilino)-N-[4-(thiazol-2-ylsulfamoyl)phenyl]butyramide Formula: C21H23ClN4O5S3 MolecularWeight: 543.07912

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N(CCCC(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=CS3)S(=O)(=O)C

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N(CCCC(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=CS3)S(=O)(=O)C

InChI

InChI=1S/C21H23ClN4O5S3/c1-15-5-6-16(22)14-19(15)26(33(2,28)29)12-3-4-20(27)24-17-7-9-18(10-8-17)34(30,31)25-21-23-11-13-32-21/h5-11,13-14H,3-4,12H2,1-2H3,(H,23,25)(H,24,27)