methyl 2-[(5-bromanylpyridin-3-yl)carbonylamino]-4-(5,6,7,8-tetrahydronaphthalen-2-yl)thiophene-3-carboxylate

Systemtic Name: methyl 2-[(5-bromanylpyridin-3-yl)carbonylamino]-4-(5,6,7,8-tetrahydronaphthalen-2-yl)thiophene-3-carboxylate Openeye Name: methyl 2-[(5-bromopyridine-3-carbonyl)amino]-4-tetralin-6-yl-thiophene-3-carboxylate CAS Name: 2-[[(5-bromo-3-pyridinyl)-oxomethyl]amino]-4-(5,6,7,8-tetrahydronaphthalen-2-yl)-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[(5-bromopyridine-3-carbonyl)amino]-4-(5,6,7,8-tetrahydronaphthalen-2-yl)thiophene-3-carboxylate Traditional Name: 2-[(5-bromonicotinoyl)amino]-4-tetralin-6-yl-thiophene-3-carboxylic acid methyl ester Formula: C22H19BrN2O3S MolecularWeight: 471.36686

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC=C1C2=CC3=C(CCCC3)C=C2)NC(=O)C4=CC(=CN=C4)Br

Isomeric SMILES

COC(=O)C1=C(SC=C1C2=CC3=C(CCCC3)C=C2)NC(=O)C4=CC(=CN=C4)Br

InChI

InChI=1S/C22H19BrN2O3S/c1-28-22(27)19-18(15-7-6-13-4-2-3-5-14(13)8-15)12-29-21(19)25-20(26)16-9-17(23)11-24-10-16/h6-12H,2-5H2,1H3,(H,25,26)