N-[4-bromanyl-2-(phenylcarbonyl)phenyl]-5-nitro-1-benzothiophene-2-carboxamide

Systemtic Name: N-[4-bromanyl-2-(phenylcarbonyl)phenyl]-5-nitro-1-benzothiophene-2-carboxamide Openeye Name: N-(2-benzoyl-4-bromo-phenyl)-5-nitro-benzothiophene-2-carboxamide CAS Name: N-(2-benzoyl-4-bromophenyl)-5-nitro-1-benzothiophene-2-carboxamide IUPAC Name: N-(2-benzoyl-4-bromophenyl)-5-nitro-1-benzothiophene-2-carboxamide Traditional Name: N-(2-benzoyl-4-bromo-phenyl)-5-nitro-benzothiophene-2-carboxamide Formula: C22H13BrN2O4S MolecularWeight: 481.31862

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C2=C(C=CC(=C2)Br)NC(=O)C3=CC4=C(S3)C=CC(=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C2=C(C=CC(=C2)Br)NC(=O)C3=CC4=C(S3)C=CC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H13BrN2O4S/c23-15-6-8-18(17(12-15)21(26)13-4-2-1-3-5-13)24-22(27)20-11-14-10-16(25(28)29)7-9-19(14)30-20/h1-12H,(H,24,27)