[2-[4-(5-chloranylthiophen-2-yl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethyl] (E)-but-2-enoate

Systemtic Name: [2-[4-(5-chloranylthiophen-2-yl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethyl] (E)-but-2-enoate Openeye Name: [2-[4-[(5-chloro-2-thienyl)sulfonyl]piperazin-1-yl]-2-oxo-ethyl] (E)-but-2-enoate CAS Name: (E)-2-butenoic acid [2-[4-[(5-chloro-2-thiophenyl)sulfonyl]-1-piperazinyl]-2-oxoethyl] ester IUPAC Name: [2-[4-(5-chlorothiophen-2-yl)sulfonylpiperazin-1-yl]-2-oxoethyl] (E)-but-2-enoate Traditional Name: (E)-but-2-enoic acid [2-[4-[(5-chloro-2-thienyl)sulfonyl]piperazino]-2-keto-ethyl] ester Formula: C14H17ClN2O5S2 MolecularWeight: 392.87818

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17ClN2O5S2/c1-2-3-13(19)22-10-12(18)16-6-8-17(9-7-16)24(20,21)14-5-4-11(15)23-14/h2-5H,6-10H2,1H3/b3-2+