ethyl 2-[3-methylsulfanyl-1-(phenylmethyl)indol-2-yl]ethanoate

Systemtic Name: ethyl 2-[3-methylsulfanyl-1-(phenylmethyl)indol-2-yl]ethanoate Openeye Name: ethyl 2-(1-benzyl-3-methylsulfanyl-indol-2-yl)acetate CAS Name: 2-[3-(methylthio)-1-(phenylmethyl)-2-indolyl]acetic acid ethyl ester IUPAC Name: ethyl 2-(1-benzyl-3-methylsulfanylindol-2-yl)acetate Traditional Name: 2-[1-benzyl-3-(methylthio)indol-2-yl]acetic acid ethyl ester Formula: C20H21NO2S MolecularWeight: 339.45124

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=C(C2=CC=CC=C2N1CC3=CC=CC=C3)SC

Isomeric SMILES

CCOC(=O)CC1=C(C2=CC=CC=C2N1CC3=CC=CC=C3)SC

InChI

InChI=1S/C20H21NO2S/c1-3-23-19(22)13-18-20(24-2)16-11-7-8-12-17(16)21(18)14-15-9-5-4-6-10-15/h4-12H,3,13-14H2,1-2H3