methyl 5-[[(5-bromanylthiophen-3-yl)carbonyl-methyl-amino]methyl]-2-methyl-furan-3-carboxylate

Systemtic Name: methyl 5-[[(5-bromanylthiophen-3-yl)carbonyl-methyl-amino]methyl]-2-methyl-furan-3-carboxylate Openeye Name: methyl 5-[[(5-bromothiophene-3-carbonyl)-methyl-amino]methyl]-2-methyl-furan-3-carboxylate CAS Name: 5-[[[(5-bromo-3-thiophenyl)-oxomethyl]-methylamino]methyl]-2-methyl-3-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[[(5-bromothiophene-3-carbonyl)-methylamino]methyl]-2-methylfuran-3-carboxylate Traditional Name: 5-[[(5-bromothiophene-3-carbonyl)-methyl-amino]methyl]-2-methyl-furan-3-carboxylic acid methyl ester Formula: C14H14BrNO4S MolecularWeight: 372.23426

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)CN(C)C(=O)C2=CSC(=C2)Br)C(=O)OC

Isomeric SMILES

CC1=C(C=C(O1)CN(C)C(=O)C2=CSC(=C2)Br)C(=O)OC

InChI

InChI=1S/C14H14BrNO4S/c1-8-11(14(18)19-3)5-10(20-8)6-16(2)13(17)9-4-12(15)21-7-9/h4-5,7H,6H2,1-3H3