tert-butyl 4-(5-chloranylthiophen-2-yl)sulfonylpiperazine-1-carboxylate

Systemtic Name: tert-butyl 4-(5-chloranylthiophen-2-yl)sulfonylpiperazine-1-carboxylate Openeye Name: tert-butyl 4-[(5-chloro-2-thienyl)sulfonyl]piperazine-1-carboxylate CAS Name: 4-[(5-chloro-2-thiophenyl)sulfonyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(5-chlorothiophen-2-yl)sulfonylpiperazine-1-carboxylate Traditional Name: 4-[(5-chloro-2-thienyl)sulfonyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C13H19ClN2O4S2 MolecularWeight: 366.88396

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=C(S2)Cl

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=C(S2)Cl

InChI

InChI=1S/C13H19ClN2O4S2/c1-13(2,3)20-12(17)15-6-8-16(9-7-15)22(18,19)11-5-4-10(14)21-11/h4-5H,6-9H2,1-3H3