ethyl 2-[2-[(5-bromanylthiophen-2-yl)methyl-ethyl-amino]ethanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-[(5-bromanylthiophen-2-yl)methyl-ethyl-amino]ethanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-[(5-bromo-2-thienyl)methyl-ethyl-amino]acetyl]amino]thiophene-3-carboxylate CAS Name: 2-[[2-[(5-bromo-2-thiophenyl)methyl-ethylamino]-1-oxoethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-[(5-bromothiophen-2-yl)methyl-ethylamino]acetyl]amino]thiophene-3-carboxylate Traditional Name: 2-[[2-[(5-bromo-2-thienyl)methyl-ethyl-amino]acetyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C16H19BrN2O3S2 MolecularWeight: 431.36766

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=C(S1)Br)CC(=O)NC2=C(C=CS2)C(=O)OCC

Isomeric SMILES

CCN(CC1=CC=C(S1)Br)CC(=O)NC2=C(C=CS2)C(=O)OCC

InChI

InChI=1S/C16H19BrN2O3S2/c1-3-19(9-11-5-6-13(17)24-11)10-14(20)18-15-12(7-8-23-15)16(21)22-4-2/h5-8H,3-4,9-10H2,1-2H3,(H,18,20)