ethyl 2-[(5-bromanylfuran-2-yl)carbonyl-phenethyl-amino]-5-methyl-1,3-thiazole-4-carboxylate

Systemtic Name: ethyl 2-[(5-bromanylfuran-2-yl)carbonyl-phenethyl-amino]-5-methyl-1,3-thiazole-4-carboxylate Openeye Name: ethyl 2-[(5-bromofuran-2-carbonyl)-phenethyl-amino]-5-methyl-thiazole-4-carboxylate CAS Name: 2-[[(5-bromo-2-furanyl)-oxomethyl]-phenethylamino]-5-methyl-4-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(5-bromofuran-2-carbonyl)-phenethylamino]-5-methyl-1,3-thiazole-4-carboxylate Traditional Name: 2-[(5-bromo-2-furoyl)-phenethyl-amino]-5-methyl-thiazole-4-carboxylic acid ethyl ester Formula: C20H19BrN2O4S MolecularWeight: 463.34486

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=N1)N(CCC2=CC=CC=C2)C(=O)C3=CC=C(O3)Br)C

Isomeric SMILES

CCOC(=O)C1=C(SC(=N1)N(CCC2=CC=CC=C2)C(=O)C3=CC=C(O3)Br)C

InChI

InChI=1S/C20H19BrN2O4S/c1-3-26-19(25)17-13(2)28-20(22-17)23(12-11-14-7-5-4-6-8-14)18(24)15-9-10-16(21)27-15/h4-10H,3,11-12H2,1-2H3