methyl 3-[(4-bromanylthiophen-2-yl)methylamino]-3-thiophen-2-yl-propanoate

Systemtic Name: methyl 3-[(4-bromanylthiophen-2-yl)methylamino]-3-thiophen-2-yl-propanoate Openeye Name: methyl 3-[(4-bromo-2-thienyl)methylamino]-3-(2-thienyl)propanoate CAS Name: 3-[(4-bromo-2-thiophenyl)methylamino]-3-thiophen-2-ylpropanoic acid methyl ester IUPAC Name: methyl 3-[(4-bromothiophen-2-yl)methylamino]-3-thiophen-2-ylpropanoate Traditional Name: 3-[(4-bromo-2-thienyl)methylamino]-3-(2-thienyl)propionic acid methyl ester Formula: C13H14BrNO2S2 MolecularWeight: 360.28976

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(C1=CC=CS1)NCC2=CC(=CS2)Br

Isomeric SMILES

COC(=O)CC(C1=CC=CS1)NCC2=CC(=CS2)Br

InChI

InChI=1S/C13H14BrNO2S2/c1-17-13(16)6-11(12-3-2-4-18-12)15-7-10-5-9(14)8-19-10/h2-5,8,11,15H,6-7H2,1H3