tert-butyl N-[3-[4-(5-chloranylthiophen-2-yl)sulfonylpiperazin-1-yl]-3-oxidanylidene-propyl]carbamate

Systemtic Name: tert-butyl N-[3-[4-(5-chloranylthiophen-2-yl)sulfonylpiperazin-1-yl]-3-oxidanylidene-propyl]carbamate Openeye Name: tert-butyl N-[3-[4-[(5-chloro-2-thienyl)sulfonyl]piperazin-1-yl]-3-oxo-propyl]carbamate CAS Name: N-[3-[4-[(5-chloro-2-thiophenyl)sulfonyl]-1-piperazinyl]-3-oxopropyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[3-[4-(5-chlorothiophen-2-yl)sulfonylpiperazin-1-yl]-3-oxopropyl]carbamate Traditional Name: N-[3-[4-[(5-chloro-2-thienyl)sulfonyl]piperazino]-3-keto-propyl]carbamic acid tert-butyl ester Formula: C16H24ClN3O5S2 MolecularWeight: 437.96186

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H24ClN3O5S2/c1-16(2,3)25-15(22)18-7-6-13(21)19-8-10-20(11-9-19)27(23,24)14-5-4-12(17)26-14/h4-5H,6-11H2,1-3H3,(H,18,22)