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

Systemtic Name: 1-[4-(5-chloranylthiophen-2-yl)sulfonylpiperazin-1-yl]-4-(4-ethylphenyl)butane-1,4-dione Openeye Name: 1-[4-[(5-chloro-2-thienyl)sulfonyl]piperazin-1-yl]-4-(4-ethylphenyl)butane-1,4-dione CAS Name: 1-[4-[(5-chloro-2-thiophenyl)sulfonyl]-1-piperazinyl]-4-(4-ethylphenyl)butane-1,4-dione IUPAC Name: 1-[4-(5-chlorothiophen-2-yl)sulfonylpiperazin-1-yl]-4-(4-ethylphenyl)butane-1,4-dione Traditional Name: 1-[4-[(5-chloro-2-thienyl)sulfonyl]piperazino]-4-(4-ethylphenyl)butane-1,4-dione Formula: C20H23ClN2O4S2 MolecularWeight: 454.99062

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)CCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(S3)Cl

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)CCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(S3)Cl

InChI

InChI=1S/C20H23ClN2O4S2/c1-2-15-3-5-16(6-4-15)17(24)7-9-19(25)22-11-13-23(14-12-22)29(26,27)20-10-8-18(21)28-20/h3-6,8,10H,2,7,9,11-14H2,1H3