methyl 2-(5-bromanyl-2-methoxy-4-pyrrolidin-1-ylcarbothioyl-phenoxy)ethanoate

Systemtic Name: methyl 2-(5-bromanyl-2-methoxy-4-pyrrolidin-1-ylcarbothioyl-phenoxy)ethanoate Openeye Name: methyl 2-[5-bromo-2-methoxy-4-(pyrrolidine-1-carbothioyl)phenoxy]acetate CAS Name: 2-[5-bromo-2-methoxy-4-[1-pyrrolidinyl(sulfanylidene)methyl]phenoxy]acetic acid methyl ester IUPAC Name: methyl 2-[5-bromo-2-methoxy-4-(pyrrolidine-1-carbothioyl)phenoxy]acetate Traditional Name: 2-[5-bromo-2-methoxy-4-(pyrrolidine-1-carbothioyl)phenoxy]acetic acid methyl ester Formula: C15H18BrNO4S MolecularWeight: 388.27672

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=S)N2CCCC2)Br)OCC(=O)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=S)N2CCCC2)Br)OCC(=O)OC

InChI

InChI=1S/C15H18BrNO4S/c1-19-12-7-10(15(22)17-5-3-4-6-17)11(16)8-13(12)21-9-14(18)20-2/h7-8H,3-6,9H2,1-2H3