N-(2-methyl-1-oxidanyl-propan-2-yl)-2-[3-methylsulfanyl-1-(phenylmethyl)indol-2-yl]ethanamide

Systemtic Name: N-(2-methyl-1-oxidanyl-propan-2-yl)-2-[3-methylsulfanyl-1-(phenylmethyl)indol-2-yl]ethanamide Openeye Name: 2-(1-benzyl-3-methylsulfanyl-indol-2-yl)-N-(2-hydroxy-1,1-dimethyl-ethyl)acetamide CAS Name: N-(1-hydroxy-2-methylpropan-2-yl)-2-[3-(methylthio)-1-(phenylmethyl)-2-indolyl]acetamide IUPAC Name: 2-(1-benzyl-3-methylsulfanylindol-2-yl)-N-(1-hydroxy-2-methylpropan-2-yl)acetamide Traditional Name: 2-[1-benzyl-3-(methylthio)indol-2-yl]-N-(2-hydroxy-1,1-dimethyl-ethyl)acetamide Formula: C22H26N2O2S MolecularWeight: 382.51904

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CO)NC(=O)CC1=C(C2=CC=CC=C2N1CC3=CC=CC=C3)SC

Isomeric SMILES

CC(C)(CO)NC(=O)CC1=C(C2=CC=CC=C2N1CC3=CC=CC=C3)SC

InChI

InChI=1S/C22H26N2O2S/c1-22(2,15-25)23-20(26)13-19-21(27-3)17-11-7-8-12-18(17)24(19)14-16-9-5-4-6-10-16/h4-12,25H,13-15H2,1-3H3,(H,23,26)