N-(4-chloranyl-2-methyl-phenyl)-5-[(4-methylphenyl)methyl-methylsulfonyl-amino]-1-benzothiophene-2-carboxamide

Systemtic Name: N-(4-chloranyl-2-methyl-phenyl)-5-[(4-methylphenyl)methyl-methylsulfonyl-amino]-1-benzothiophene-2-carboxamide Openeye Name: N-(4-chloro-2-methyl-phenyl)-5-[methylsulfonyl(p-tolylmethyl)amino]benzothiophene-2-carboxamide CAS Name: N-(4-chloro-2-methylphenyl)-5-[(4-methylphenyl)methyl-methylsulfonylamino]-1-benzothiophene-2-carboxamide IUPAC Name: N-(4-chloro-2-methylphenyl)-5-[(4-methylphenyl)methyl-methylsulfonylamino]-1-benzothiophene-2-carboxamide Traditional Name: N-(4-chloro-2-methyl-phenyl)-5-[mesyl-(4-methylbenzyl)amino]benzothiophene-2-carboxamide Formula: C25H23ClN2O3S2 MolecularWeight: 499.04472

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN(C2=CC3=C(C=C2)SC(=C3)C(=O)NC4=C(C=C(C=C4)Cl)C)S(=O)(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)CN(C2=CC3=C(C=C2)SC(=C3)C(=O)NC4=C(C=C(C=C4)Cl)C)S(=O)(=O)C

InChI

InChI=1S/C25H23ClN2O3S2/c1-16-4-6-18(7-5-16)15-28(33(3,30)31)21-9-11-23-19(13-21)14-24(32-23)25(29)27-22-10-8-20(26)12-17(22)2/h4-14H,15H2,1-3H3,(H,27,29)