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

Systemtic Name: N-(2,4-dimethylphenyl)-2-[1-[(2,5-dimethylphenyl)methyl]indol-3-yl]sulfanyl-ethanamide Openeye Name: N-(2,4-dimethylphenyl)-2-[1-[(2,5-dimethylphenyl)methyl]indol-3-yl]sulfanyl-acetamide CAS Name: N-(2,4-dimethylphenyl)-2-[[1-[(2,5-dimethylphenyl)methyl]-3-indolyl]thio]acetamide IUPAC Name: N-(2,4-dimethylphenyl)-2-[1-[(2,5-dimethylphenyl)methyl]indol-3-yl]sulfanylacetamide Traditional Name: 2-[[1-(2,5-dimethylbenzyl)indol-3-yl]thio]-N-(2,4-dimethylphenyl)acetamide Formula: C27H28N2OS MolecularWeight: 428.58902

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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