N-[4-bromanyl-2-(phenylcarbonyl)phenyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: N-[4-bromanyl-2-(phenylcarbonyl)phenyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: N-(2-benzoyl-4-bromo-phenyl)-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: N-(2-benzoyl-4-bromophenyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: N-(2-benzoyl-4-bromophenyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: N-(2-benzoyl-4-bromo-phenyl)-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C22H18BrNO2S MolecularWeight: 440.35282

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=CS2)C(=O)NC3=C(C=C(C=C3)Br)C(=O)C4=CC=CC=C4

Isomeric SMILES

C1CCC2=C(C1)C(=CS2)C(=O)NC3=C(C=C(C=C3)Br)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H18BrNO2S/c23-15-10-11-19(17(12-15)21(25)14-6-2-1-3-7-14)24-22(26)18-13-27-20-9-5-4-8-16(18)20/h1-3,6-7,10-13H,4-5,8-9H2,(H,24,26)