2-methylpropyl 4-(5-bromanylthiophen-2-yl)sulfonylpiperazine-1-carboxylate

Systemtic Name: 2-methylpropyl 4-(5-bromanylthiophen-2-yl)sulfonylpiperazine-1-carboxylate Openeye Name: isobutyl 4-[(5-bromo-2-thienyl)sulfonyl]piperazine-1-carboxylate CAS Name: 4-[(5-bromo-2-thiophenyl)sulfonyl]-1-piperazinecarboxylic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 4-(5-bromothiophen-2-yl)sulfonylpiperazine-1-carboxylate Traditional Name: 4-[(5-bromo-2-thienyl)sulfonyl]piperazine-1-carboxylic acid isobutyl ester Formula: C13H19BrN2O4S2 MolecularWeight: 411.33496

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=C(S2)Br

Isomeric SMILES

CC(C)COC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=C(S2)Br

InChI

InChI=1S/C13H19BrN2O4S2/c1-10(2)9-20-13(17)15-5-7-16(8-6-15)22(18,19)12-4-3-11(14)21-12/h3-4,10H,5-9H2,1-2H3