(3-chloranyl-1-benzothiophen-2-yl)methyl 4-(2-cyanoethylsulfamoyl)benzoate

Systemtic Name: (3-chloranyl-1-benzothiophen-2-yl)methyl 4-(2-cyanoethylsulfamoyl)benzoate Openeye Name: (3-chlorobenzothiophen-2-yl)methyl 4-(2-cyanoethylsulfamoyl)benzoate CAS Name: 4-(2-cyanoethylsulfamoyl)benzoic acid (3-chloro-1-benzothiophen-2-yl)methyl ester IUPAC Name: (3-chloro-1-benzothiophen-2-yl)methyl 4-(2-cyanoethylsulfamoyl)benzoate Traditional Name: 4-(2-cyanoethylsulfamoyl)benzoic acid (3-chlorobenzothiophen-2-yl)methyl ester Formula: C19H15ClN2O4S2 MolecularWeight: 434.9164

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(S2)COC(=O)C3=CC=C(C=C3)S(=O)(=O)NCCC#N)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(S2)COC(=O)C3=CC=C(C=C3)S(=O)(=O)NCCC#N)Cl

InChI

InChI=1S/C19H15ClN2O4S2/c20-18-15-4-1-2-5-16(15)27-17(18)12-26-19(23)13-6-8-14(9-7-13)28(24,25)22-11-3-10-21/h1-2,4-9,22H,3,11-12H2