N-[4-bromanyl-2-(phenylcarbonyl)phenyl]-4-(phenylmethylsulfanyl)butanamide

Systemtic Name: N-[4-bromanyl-2-(phenylcarbonyl)phenyl]-4-(phenylmethylsulfanyl)butanamide Openeye Name: N-(2-benzoyl-4-bromo-phenyl)-4-benzylsulfanyl-butanamide CAS Name: N-(2-benzoyl-4-bromophenyl)-4-(phenylmethylthio)butanamide IUPAC Name: N-(2-benzoyl-4-bromophenyl)-4-benzylsulfanylbutanamide Traditional Name: N-(2-benzoyl-4-bromo-phenyl)-4-(benzylthio)butyramide Formula: C24H22BrNO2S MolecularWeight: 468.40598

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSCCCC(=O)NC2=C(C=C(C=C2)Br)C(=O)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CSCCCC(=O)NC2=C(C=C(C=C2)Br)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C24H22BrNO2S/c25-20-13-14-22(21(16-20)24(28)19-10-5-2-6-11-19)26-23(27)12-7-15-29-17-18-8-3-1-4-9-18/h1-6,8-11,13-14,16H,7,12,15,17H2,(H,26,27)