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

Systemtic Name: ethyl 2-[1-(phenylmethyl)-3-phenylsulfanyl-indol-2-yl]ethanoate Openeye Name: ethyl 2-(1-benzyl-3-phenylsulfanyl-indol-2-yl)acetate CAS Name: 2-[1-(phenylmethyl)-3-(phenylthio)-2-indolyl]acetic acid ethyl ester IUPAC Name: ethyl 2-(1-benzyl-3-phenylsulfanylindol-2-yl)acetate Traditional Name: 2-[1-benzyl-3-(phenylthio)indol-2-yl]acetic acid ethyl ester Formula: C25H23NO2S MolecularWeight: 401.52062

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=C(C2=CC=CC=C2N1CC3=CC=CC=C3)SC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)CC1=C(C2=CC=CC=C2N1CC3=CC=CC=C3)SC4=CC=CC=C4

InChI

InChI=1S/C25H23NO2S/c1-2-28-24(27)17-23-25(29-20-13-7-4-8-14-20)21-15-9-10-16-22(21)26(23)18-19-11-5-3-6-12-19/h3-16H,2,17-18H2,1H3