tert-butyl 4-[2,5-bis(chloranyl)thiophen-3-yl]sulfonylpiperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[2,5-bis(chloranyl)thiophen-3-yl]sulfonylpiperazine-1-carboxylate Openeye Name: tert-butyl 4-[(2,5-dichloro-3-thienyl)sulfonyl]piperazine-1-carboxylate CAS Name: 4-[(2,5-dichloro-3-thiophenyl)sulfonyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(2,5-dichlorothiophen-3-yl)sulfonylpiperazine-1-carboxylate Traditional Name: 4-[(2,5-dichloro-3-thienyl)sulfonyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C13H18Cl2N2O4S2 MolecularWeight: 401.32902

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)S(=O)(=O)C2=C(SC(=C2)Cl)Cl

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)S(=O)(=O)C2=C(SC(=C2)Cl)Cl

InChI

InChI=1S/C13H18Cl2N2O4S2/c1-13(2,3)21-12(18)16-4-6-17(7-5-16)23(19,20)9-8-10(14)22-11(9)15/h8H,4-7H2,1-3H3