5-[(4-chlorophenyl)methyl-methylsulfonyl-amino]-N-(3-nitrophenyl)-1-benzothiophene-2-carboxamide

Systemtic Name: 5-[(4-chlorophenyl)methyl-methylsulfonyl-amino]-N-(3-nitrophenyl)-1-benzothiophene-2-carboxamide Openeye Name: 5-[(4-chlorophenyl)methyl-methylsulfonyl-amino]-N-(3-nitrophenyl)benzothiophene-2-carboxamide CAS Name: 5-[(4-chlorophenyl)methyl-methylsulfonylamino]-N-(3-nitrophenyl)-1-benzothiophene-2-carboxamide IUPAC Name: 5-[(4-chlorophenyl)methyl-methylsulfonylamino]-N-(3-nitrophenyl)-1-benzothiophene-2-carboxamide Traditional Name: 5-[(4-chlorobenzyl)-mesyl-amino]-N-(3-nitrophenyl)benzothiophene-2-carboxamide Formula: C23H18ClN3O5S2 MolecularWeight: 515.98912

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CC1=CC=C(C=C1)Cl)C2=CC3=C(C=C2)SC(=C3)C(=O)NC4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)N(CC1=CC=C(C=C1)Cl)C2=CC3=C(C=C2)SC(=C3)C(=O)NC4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H18ClN3O5S2/c1-34(31,32)26(14-15-5-7-17(24)8-6-15)19-9-10-21-16(11-19)12-22(33-21)23(28)25-18-3-2-4-20(13-18)27(29)30/h2-13H,14H2,1H3,(H,25,28)