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

Systemtic Name: 2-[1-[(3-methylphenyl)methyl]indol-3-yl]sulfanyl-N-(2,4,6-trimethylphenyl)ethanamide Openeye Name: 2-[1-(m-tolylmethyl)indol-3-yl]sulfanyl-N-(2,4,6-trimethylphenyl)acetamide CAS Name: 2-[[1-[(3-methylphenyl)methyl]-3-indolyl]thio]-N-(2,4,6-trimethylphenyl)acetamide IUPAC Name: 2-[1-[(3-methylphenyl)methyl]indol-3-yl]sulfanyl-N-(2,4,6-trimethylphenyl)acetamide Traditional Name: N-mesityl-2-[[1-(3-methylbenzyl)indol-3-yl]thio]acetamide Formula: C27H28N2OS MolecularWeight: 428.58902

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2C=C(C3=CC=CC=C32)SCC(=O)NC4=C(C=C(C=C4C)C)C

Isomeric SMILES

CC1=CC(=CC=C1)CN2C=C(C3=CC=CC=C32)SCC(=O)NC4=C(C=C(C=C4C)C)C

InChI

InChI=1S/C27H28N2OS/c1-18-8-7-9-22(14-18)15-29-16-25(23-10-5-6-11-24(23)29)31-17-26(30)28-27-20(3)12-19(2)13-21(27)4/h5-14,16H,15,17H2,1-4H3,(H,28,30)