3-[2-[4-(5-chloranylthiophen-2-yl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethyl]-3H-2-benzofuran-1-one

Systemtic Name: 3-[2-[4-(5-chloranylthiophen-2-yl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethyl]-3H-2-benzofuran-1-one Openeye Name: 3-[2-[4-[(5-chloro-2-thienyl)sulfonyl]piperazin-1-yl]-2-oxo-ethyl]-3H-isobenzofuran-1-one CAS Name: 3-[2-[4-[(5-chloro-2-thiophenyl)sulfonyl]-1-piperazinyl]-2-oxoethyl]-3H-isobenzofuran-1-one IUPAC Name: 3-[2-[4-(5-chlorothiophen-2-yl)sulfonylpiperazin-1-yl]-2-oxoethyl]-3H-2-benzofuran-1-one Traditional Name: 3-[2-[4-[(5-chloro-2-thienyl)sulfonyl]piperazino]-2-keto-ethyl]phthalide Formula: C18H17ClN2O5S2 MolecularWeight: 440.92098

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CC2C3=CC=CC=C3C(=O)O2)S(=O)(=O)C4=CC=C(S4)Cl

Isomeric SMILES

C1CN(CCN1C(=O)CC2C3=CC=CC=C3C(=O)O2)S(=O)(=O)C4=CC=C(S4)Cl

InChI

InChI=1S/C18H17ClN2O5S2/c19-15-5-6-17(27-15)28(24,25)21-9-7-20(8-10-21)16(22)11-14-12-3-1-2-4-13(12)18(23)26-14/h1-6,14H,7-11H2