methyl 5-bromanyl-4-piperazin-1-ylsulfonyl-thiophene-2-carboxylate

Systemtic Name: methyl 5-bromanyl-4-piperazin-1-ylsulfonyl-thiophene-2-carboxylate Openeye Name: methyl 5-bromo-4-piperazin-1-ylsulfonyl-thiophene-2-carboxylate CAS Name: 5-bromo-4-(1-piperazinylsulfonyl)-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-bromo-4-piperazin-1-ylsulfonylthiophene-2-carboxylate Traditional Name: 5-bromo-4-piperazinosulfonyl-thiophene-2-carboxylic acid methyl ester Formula: C10H13BrN2O4S2 MolecularWeight: 369.25522

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(S1)Br)S(=O)(=O)N2CCNCC2

Isomeric SMILES

COC(=O)C1=CC(=C(S1)Br)S(=O)(=O)N2CCNCC2

InChI

InChI=1S/C10H13BrN2O4S2/c1-17-10(14)7-6-8(9(11)18-7)19(15,16)13-4-2-12-3-5-13/h6,12H,2-5H2,1H3