1-[4-(5-chloranylthiophen-2-yl)sulfonylpiperazin-1-yl]-2-(2-methoxy-4-prop-2-enyl-phenoxy)ethanone

Systemtic Name: 1-[4-(5-chloranylthiophen-2-yl)sulfonylpiperazin-1-yl]-2-(2-methoxy-4-prop-2-enyl-phenoxy)ethanone Openeye Name: 2-(4-allyl-2-methoxy-phenoxy)-1-[4-[(5-chloro-2-thienyl)sulfonyl]piperazin-1-yl]ethanone CAS Name: 1-[4-[(5-chloro-2-thiophenyl)sulfonyl]-1-piperazinyl]-2-(2-methoxy-4-prop-2-enylphenoxy)ethanone IUPAC Name: 1-[4-(5-chlorothiophen-2-yl)sulfonylpiperazin-1-yl]-2-(2-methoxy-4-prop-2-enylphenoxy)ethanone Traditional Name: 2-(4-allyl-2-methoxy-phenoxy)-1-[4-[(5-chloro-2-thienyl)sulfonyl]piperazino]ethanone Formula: C20H23ClN2O5S2 MolecularWeight: 470.99002

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CC=C)OCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(S3)Cl

Isomeric SMILES

COC1=C(C=CC(=C1)CC=C)OCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(S3)Cl

InChI

InChI=1S/C20H23ClN2O5S2/c1-3-4-15-5-6-16(17(13-15)27-2)28-14-19(24)22-9-11-23(12-10-22)30(25,26)20-8-7-18(21)29-20/h3,5-8,13H,1,4,9-12,14H2,2H3