ethyl 4-[3-(2-methylsulfanylpropan-2-ylamino)-2-oxidanyl-propoxy]-1H-indole-2-carboxylate

Systemtic Name: ethyl 4-[3-(2-methylsulfanylpropan-2-ylamino)-2-oxidanyl-propoxy]-1H-indole-2-carboxylate Openeye Name: ethyl 4-[2-hydroxy-3-[(1-methyl-1-methylsulfanyl-ethyl)amino]propoxy]-1H-indole-2-carboxylate CAS Name: 4-[2-hydroxy-3-[2-(methylthio)propan-2-ylamino]propoxy]-1H-indole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-hydroxy-3-(2-methylsulfanylpropan-2-ylamino)propoxy]-1H-indole-2-carboxylate Traditional Name: 4-[2-hydroxy-3-[[1-methyl-1-(methylthio)ethyl]amino]propoxy]-1H-indole-2-carboxylic acid ethyl ester Formula: C18H26N2O4S MolecularWeight: 366.47504

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(N1)C=CC=C2OCC(CNC(C)(C)SC)O

Isomeric SMILES

CCOC(=O)C1=CC2=C(N1)C=CC=C2OCC(CNC(C)(C)SC)O

InChI

InChI=1S/C18H26N2O4S/c1-5-23-17(22)15-9-13-14(20-15)7-6-8-16(13)24-11-12(21)10-19-18(2,3)25-4/h6-9,12,19-21H,5,10-11H2,1-4H3