methyl 5-bromanyl-4-phenyl-2-(2-piperidin-1-ylethanoylamino)thiophene-3-carboxylate

Systemtic Name: methyl 5-bromanyl-4-phenyl-2-(2-piperidin-1-ylethanoylamino)thiophene-3-carboxylate Openeye Name: methyl 5-bromo-4-phenyl-2-[[2-(1-piperidyl)acetyl]amino]thiophene-3-carboxylate CAS Name: 5-bromo-2-[[1-oxo-2-(1-piperidinyl)ethyl]amino]-4-phenyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-bromo-4-phenyl-2-[(2-piperidin-1-ylacetyl)amino]thiophene-3-carboxylate Traditional Name: 5-bromo-4-phenyl-2-[(2-piperidinoacetyl)amino]thiophene-3-carboxylic acid methyl ester Formula: C19H21BrN2O3S MolecularWeight: 437.35064

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC(=C1C2=CC=CC=C2)Br)NC(=O)CN3CCCCC3

Isomeric SMILES

COC(=O)C1=C(SC(=C1C2=CC=CC=C2)Br)NC(=O)CN3CCCCC3

InChI

InChI=1S/C19H21BrN2O3S/c1-25-19(24)16-15(13-8-4-2-5-9-13)17(20)26-18(16)21-14(23)12-22-10-6-3-7-11-22/h2,4-5,8-9H,3,6-7,10-12H2,1H3,(H,21,23)