[2-[(2-bromanyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl] 2-(2,3-dihydro-1H-inden-5-ylsulfanyl)ethanoate

Systemtic Name: [2-[(2-bromanyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl] 2-(2,3-dihydro-1H-inden-5-ylsulfanyl)ethanoate Openeye Name: [2-(2-bromo-4-methyl-anilino)-2-oxo-ethyl] 2-indan-5-ylsulfanylacetate CAS Name: 2-(2,3-dihydro-1H-inden-5-ylthio)acetic acid [2-(2-bromo-4-methylanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-bromo-4-methylanilino)-2-oxoethyl] 2-(2,3-dihydro-1H-inden-5-ylsulfanyl)acetate Traditional Name: 2-(indan-5-ylthio)acetic acid [2-(2-bromo-4-methyl-anilino)-2-keto-ethyl] ester Formula: C20H20BrNO3S MolecularWeight: 434.3467

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)COC(=O)CSC2=CC3=C(CCC3)C=C2)Br

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)COC(=O)CSC2=CC3=C(CCC3)C=C2)Br

InChI

InChI=1S/C20H20BrNO3S/c1-13-5-8-18(17(21)9-13)22-19(23)11-25-20(24)12-26-16-7-6-14-3-2-4-15(14)10-16/h5-10H,2-4,11-12H2,1H3,(H,22,23)