1-[5-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]carbonylthiophen-2-yl]ethanone

Systemtic Name: 1-[5-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]carbonylthiophen-2-yl]ethanone Openeye Name: 1-[5-[4-(4-tert-butylphenyl)sulfonylpiperazine-1-carbonyl]-2-thienyl]ethanone CAS Name: 1-[5-[[4-(4-tert-butylphenyl)sulfonyl-1-piperazinyl]-oxomethyl]-2-thiophenyl]ethanone IUPAC Name: 1-[5-[4-(4-tert-butylphenyl)sulfonylpiperazine-1-carbonyl]thiophen-2-yl]ethanone Traditional Name: 1-[5-[4-(4-tert-butylphenyl)sulfonylpiperazine-1-carbonyl]-2-thienyl]ethanone Formula: C21H26N2O4S2 MolecularWeight: 434.57214

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(S1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CC(=O)C1=CC=C(S1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C21H26N2O4S2/c1-15(24)18-9-10-19(28-18)20(25)22-11-13-23(14-12-22)29(26,27)17-7-5-16(6-8-17)21(2,3)4/h5-10H,11-14H2,1-4H3