1-[4-(5-chloranylthiophen-2-yl)sulfonylpiperazin-1-yl]-4-(2-ethoxyphenoxy)butan-1-one

Systemtic Name: 1-[4-(5-chloranylthiophen-2-yl)sulfonylpiperazin-1-yl]-4-(2-ethoxyphenoxy)butan-1-one Openeye Name: 1-[4-[(5-chloro-2-thienyl)sulfonyl]piperazin-1-yl]-4-(2-ethoxyphenoxy)butan-1-one CAS Name: 1-[4-[(5-chloro-2-thiophenyl)sulfonyl]-1-piperazinyl]-4-(2-ethoxyphenoxy)-1-butanone IUPAC Name: 1-[4-(5-chlorothiophen-2-yl)sulfonylpiperazin-1-yl]-4-(2-ethoxyphenoxy)butan-1-one Traditional Name: 1-[4-[(5-chloro-2-thienyl)sulfonyl]piperazino]-4-(2-ethoxyphenoxy)butan-1-one Formula: C20H25ClN2O5S2 MolecularWeight: 473.0059

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1OCCCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(S3)Cl

Isomeric SMILES

CCOC1=CC=CC=C1OCCCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(S3)Cl

InChI

InChI=1S/C20H25ClN2O5S2/c1-2-27-16-6-3-4-7-17(16)28-15-5-8-19(24)22-11-13-23(14-12-22)30(25,26)20-10-9-18(21)29-20/h3-4,6-7,9-10H,2,5,8,11-15H2,1H3