2-[1-[(4-bromophenyl)methyl]indol-3-yl]sulfanyl-N-(2,5-dimethylphenyl)ethanamide

Systemtic Name: 2-[1-[(4-bromophenyl)methyl]indol-3-yl]sulfanyl-N-(2,5-dimethylphenyl)ethanamide Openeye Name: 2-[1-[(4-bromophenyl)methyl]indol-3-yl]sulfanyl-N-(2,5-dimethylphenyl)acetamide CAS Name: 2-[[1-[(4-bromophenyl)methyl]-3-indolyl]thio]-N-(2,5-dimethylphenyl)acetamide IUPAC Name: 2-[1-[(4-bromophenyl)methyl]indol-3-yl]sulfanyl-N-(2,5-dimethylphenyl)acetamide Traditional Name: 2-[[1-(4-bromobenzyl)indol-3-yl]thio]-N-(2,5-dimethylphenyl)acetamide Formula: C25H23BrN2OS MolecularWeight: 479.43192

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=O)CSC2=CN(C3=CC=CC=C32)CC4=CC=C(C=C4)Br

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=O)CSC2=CN(C3=CC=CC=C32)CC4=CC=C(C=C4)Br

InChI

InChI=1S/C25H23BrN2OS/c1-17-7-8-18(2)22(13-17)27-25(29)16-30-24-15-28(23-6-4-3-5-21(23)24)14-19-9-11-20(26)12-10-19/h3-13,15H,14,16H2,1-2H3,(H,27,29)