2-[1-[(4-bromophenyl)methyl]indol-3-yl]sulfanyl-N-(2,4,6-trimethylphenyl)ethanamide

Systemtic Name: 2-[1-[(4-bromophenyl)methyl]indol-3-yl]sulfanyl-N-(2,4,6-trimethylphenyl)ethanamide Openeye Name: 2-[1-[(4-bromophenyl)methyl]indol-3-yl]sulfanyl-N-(2,4,6-trimethylphenyl)acetamide CAS Name: 2-[[1-[(4-bromophenyl)methyl]-3-indolyl]thio]-N-(2,4,6-trimethylphenyl)acetamide IUPAC Name: 2-[1-[(4-bromophenyl)methyl]indol-3-yl]sulfanyl-N-(2,4,6-trimethylphenyl)acetamide Traditional Name: 2-[[1-(4-bromobenzyl)indol-3-yl]thio]-N-mesityl-acetamide Formula: C26H25BrN2OS MolecularWeight: 493.4585

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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)C

Isomeric SMILES

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

InChI

InChI=1S/C26H25BrN2OS/c1-17-12-18(2)26(19(3)13-17)28-25(30)16-31-24-15-29(23-7-5-4-6-22(23)24)14-20-8-10-21(27)11-9-20/h4-13,15H,14,16H2,1-3H3,(H,28,30)