ethyl 2-[1-[(4-bromophenyl)methyl]indol-3-yl]sulfanylethanoate

Systemtic Name: ethyl 2-[1-[(4-bromophenyl)methyl]indol-3-yl]sulfanylethanoate Openeye Name: ethyl 2-[1-[(4-bromophenyl)methyl]indol-3-yl]sulfanylacetate CAS Name: 2-[[1-[(4-bromophenyl)methyl]-3-indolyl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[1-[(4-bromophenyl)methyl]indol-3-yl]sulfanylacetate Traditional Name: 2-[[1-(4-bromobenzyl)indol-3-yl]thio]acetic acid ethyl ester Formula: C19H18BrNO2S MolecularWeight: 404.32072

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=CN(C2=CC=CC=C21)CC3=CC=C(C=C3)Br

Isomeric SMILES

CCOC(=O)CSC1=CN(C2=CC=CC=C21)CC3=CC=C(C=C3)Br

InChI

InChI=1S/C19H18BrNO2S/c1-2-23-19(22)13-24-18-12-21(17-6-4-3-5-16(17)18)11-14-7-9-15(20)10-8-14/h3-10,12H,2,11,13H2,1H3