N-(2-methylsulfonylphenyl)-5-nitro-1-benzothiophene-2-carboxamide

Systemtic Name: N-(2-methylsulfonylphenyl)-5-nitro-1-benzothiophene-2-carboxamide Openeye Name: N-(2-methylsulfonylphenyl)-5-nitro-benzothiophene-2-carboxamide CAS Name: N-(2-methylsulfonylphenyl)-5-nitro-1-benzothiophene-2-carboxamide IUPAC Name: N-(2-methylsulfonylphenyl)-5-nitro-1-benzothiophene-2-carboxamide Traditional Name: N-(2-mesylphenyl)-5-nitro-benzothiophene-2-carboxamide Formula: C16H12N2O5S2 MolecularWeight: 376.40688

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC=C1NC(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)C1=CC=CC=C1NC(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H12N2O5S2/c1-25(22,23)15-5-3-2-4-12(15)17-16(19)14-9-10-8-11(18(20)21)6-7-13(10)24-14/h2-9H,1H3,(H,17,19)