methyl 3-[[(E)-3-(5-bromanyl-2-fluoranyl-phenyl)prop-2-enoyl]amino]thiophene-2-carboxylate

Systemtic Name: methyl 3-[[(E)-3-(5-bromanyl-2-fluoranyl-phenyl)prop-2-enoyl]amino]thiophene-2-carboxylate Openeye Name: methyl 3-[[(E)-3-(5-bromo-2-fluoro-phenyl)prop-2-enoyl]amino]thiophene-2-carboxylate CAS Name: 3-[[(E)-3-(5-bromo-2-fluorophenyl)-1-oxoprop-2-enyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[[(E)-3-(5-bromo-2-fluorophenyl)prop-2-enoyl]amino]thiophene-2-carboxylate Traditional Name: 3-[[(E)-3-(5-bromo-2-fluoro-phenyl)acryloyl]amino]thiophene-2-carboxylic acid methyl ester Formula: C15H11BrFNO3S MolecularWeight: 384.220143

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CS1)NC(=O)C=CC2=C(C=CC(=C2)Br)F

Isomeric SMILES

COC(=O)C1=C(C=CS1)NC(=O)/C=C/C2=C(C=CC(=C2)Br)F

InChI

InChI=1S/C15H11BrFNO3S/c1-21-15(20)14-12(6-7-22-14)18-13(19)5-2-9-8-10(16)3-4-11(9)17/h2-8H,1H3,(H,18,19)/b5-2+