ethyl 3-bromanyl-4-[(5-bromanylthiophen-2-yl)methylamino]benzoate

Systemtic Name: ethyl 3-bromanyl-4-[(5-bromanylthiophen-2-yl)methylamino]benzoate Openeye Name: ethyl 3-bromo-4-[(5-bromo-2-thienyl)methylamino]benzoate CAS Name: 3-bromo-4-[(5-bromo-2-thiophenyl)methylamino]benzoic acid ethyl ester IUPAC Name: ethyl 3-bromo-4-[(5-bromothiophen-2-yl)methylamino]benzoate Traditional Name: 3-bromo-4-[(5-bromo-2-thienyl)methylamino]benzoic acid ethyl ester Formula: C14H13Br2NO2S MolecularWeight: 419.13152

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1)NCC2=CC=C(S2)Br)Br

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1)NCC2=CC=C(S2)Br)Br

InChI

InChI=1S/C14H13Br2NO2S/c1-2-19-14(18)9-3-5-12(11(15)7-9)17-8-10-4-6-13(16)20-10/h3-7,17H,2,8H2,1H3