methyl 1-[[5-bromanyl-2-(thiophen-2-ylmethoxy)phenyl]methyl]-6-(ethylamino)-2H-pyridine-3-carboxylate

Systemtic Name: methyl 1-[[5-bromanyl-2-(thiophen-2-ylmethoxy)phenyl]methyl]-6-(ethylamino)-2H-pyridine-3-carboxylate Openeye Name: methyl 1-[[5-bromo-2-(2-thienylmethoxy)phenyl]methyl]-6-(ethylamino)-2H-pyridine-3-carboxylate CAS Name: 1-[[5-bromo-2-(thiophen-2-ylmethoxy)phenyl]methyl]-6-(ethylamino)-2H-pyridine-3-carboxylic acid methyl ester IUPAC Name: methyl 1-[[5-bromo-2-(thiophen-2-ylmethoxy)phenyl]methyl]-6-(ethylamino)-2H-pyridine-3-carboxylate Traditional Name: 1-[5-bromo-2-(2-thenyloxy)benzyl]-6-(ethylamino)-2H-pyridine-3-carboxylic acid methyl ester Formula: C21H23BrN2O3S MolecularWeight: 463.38792

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=CC=C(CN1CC2=C(C=CC(=C2)Br)OCC3=CC=CS3)C(=O)OC

Isomeric SMILES

CCNC1=CC=C(CN1CC2=C(C=CC(=C2)Br)OCC3=CC=CS3)C(=O)OC

InChI

InChI=1S/C21H23BrN2O3S/c1-3-23-20-9-6-15(21(25)26-2)12-24(20)13-16-11-17(22)7-8-19(16)27-14-18-5-4-10-28-18/h4-11,23H,3,12-14H2,1-2H3