1-(5-chloranylthiophen-2-yl)-4-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]butane-1,4-dione

Systemtic Name: 1-(5-chloranylthiophen-2-yl)-4-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]butane-1,4-dione Openeye Name: 1-(5-chloro-2-thienyl)-4-[4-[(E)-styryl]sulfonylpiperazin-1-yl]butane-1,4-dione CAS Name: 1-(5-chloro-2-thiophenyl)-4-[4-[(E)-2-phenylethenyl]sulfonyl-1-piperazinyl]butane-1,4-dione IUPAC Name: 1-(5-chlorothiophen-2-yl)-4-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]butane-1,4-dione Traditional Name: 1-(5-chloro-2-thienyl)-4-[4-[(E)-styryl]sulfonylpiperazino]butane-1,4-dione Formula: C20H21ClN2O4S2 MolecularWeight: 452.97474

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CCC(=O)C2=CC=C(S2)Cl)S(=O)(=O)C=CC3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1C(=O)CCC(=O)C2=CC=C(S2)Cl)S(=O)(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C20H21ClN2O4S2/c21-19-8-7-18(28-19)17(24)6-9-20(25)22-11-13-23(14-12-22)29(26,27)15-10-16-4-2-1-3-5-16/h1-5,7-8,10,15H,6,9,11-14H2/b15-10+