methyl 2-(3-bicyclo[2.2.1]heptanylcarbonylamino)-4-(4-bromophenyl)thiophene-3-carboxylate

Systemtic Name: methyl 2-(3-bicyclo[2.2.1]heptanylcarbonylamino)-4-(4-bromophenyl)thiophene-3-carboxylate Openeye Name: methyl 4-(4-bromophenyl)-2-(norbornane-2-carbonylamino)thiophene-3-carboxylate CAS Name: 2-[[3-bicyclo[2.2.1]heptanyl(oxo)methyl]amino]-4-(4-bromophenyl)-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-(bicyclo[2.2.1]heptane-3-carbonylamino)-4-(4-bromophenyl)thiophene-3-carboxylate Traditional Name: 4-(4-bromophenyl)-2-(norbornane-2-carbonylamino)thiophene-3-carboxylic acid methyl ester Formula: C20H20BrNO3S MolecularWeight: 434.3467

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC=C1C2=CC=C(C=C2)Br)NC(=O)C3CC4CCC3C4

Isomeric SMILES

COC(=O)C1=C(SC=C1C2=CC=C(C=C2)Br)NC(=O)C3CC4CCC3C4

InChI

InChI=1S/C20H20BrNO3S/c1-25-20(24)17-16(12-4-6-14(21)7-5-12)10-26-19(17)22-18(23)15-9-11-2-3-13(15)8-11/h4-7,10-11,13,15H,2-3,8-9H2,1H3,(H,22,23)