3-chloranyl-N-[5-(diethylsulfamoyl)-2-[(2-methoxyphenyl)amino]phenyl]-6-fluoranyl-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[5-(diethylsulfamoyl)-2-[(2-methoxyphenyl)amino]phenyl]-6-fluoranyl-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[5-(diethylsulfamoyl)-2-(2-methoxyanilino)phenyl]-6-fluoro-benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[5-(diethylsulfamoyl)-2-(2-methoxyanilino)phenyl]-6-fluoro-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[5-(diethylsulfamoyl)-2-(2-methoxyanilino)phenyl]-6-fluoro-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[5-(diethylsulfamoyl)-2-(o-anisidino)phenyl]-6-fluoro-benzothiophene-2-carboxamide Formula: C26H25ClFN3O4S2 MolecularWeight: 562.075803

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)NC2=CC=CC=C2OC)NC(=O)C3=C(C4=C(S3)C=C(C=C4)F)Cl

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)NC2=CC=CC=C2OC)NC(=O)C3=C(C4=C(S3)C=C(C=C4)F)Cl

InChI

InChI=1S/C26H25ClFN3O4S2/c1-4-31(5-2)37(33,34)17-11-13-19(29-20-8-6-7-9-22(20)35-3)21(15-17)30-26(32)25-24(27)18-12-10-16(28)14-23(18)36-25/h6-15,29H,4-5H2,1-3H3,(H,30,32)