ethyl 2-[(4-bromanyl-2-fluoranyl-phenyl)methylcarbamoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 2-[(4-bromanyl-2-fluoranyl-phenyl)methylcarbamoylamino]thiophene-3-carboxylate Openeye Name: ethyl 2-[(4-bromo-2-fluoro-phenyl)methylcarbamoylamino]thiophene-3-carboxylate CAS Name: 2-[[[(4-bromo-2-fluorophenyl)methylamino]-oxomethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(4-bromo-2-fluorophenyl)methylcarbamoylamino]thiophene-3-carboxylate Traditional Name: 2-[(4-bromo-2-fluoro-benzyl)carbamoylamino]thiophene-3-carboxylic acid ethyl ester Formula: C15H14BrFN2O3S MolecularWeight: 401.250663

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1)NC(=O)NCC2=C(C=C(C=C2)Br)F

Isomeric SMILES

CCOC(=O)C1=C(SC=C1)NC(=O)NCC2=C(C=C(C=C2)Br)F

InChI

InChI=1S/C15H14BrFN2O3S/c1-2-22-14(20)11-5-6-23-13(11)19-15(21)18-8-9-3-4-10(16)7-12(9)17/h3-7H,2,8H2,1H3,(H2,18,19,21)