1-[4-(2,3,5,6-tetramethylphenyl)sulfonylpiperazin-1-yl]-4-thiophen-2-yl-butan-1-one

Systemtic Name: 1-[4-(2,3,5,6-tetramethylphenyl)sulfonylpiperazin-1-yl]-4-thiophen-2-yl-butan-1-one Openeye Name: 1-[4-(2,3,5,6-tetramethylphenyl)sulfonylpiperazin-1-yl]-4-(2-thienyl)butan-1-one CAS Name: 1-[4-(2,3,5,6-tetramethylphenyl)sulfonyl-1-piperazinyl]-4-thiophen-2-yl-1-butanone IUPAC Name: 1-[4-(2,3,5,6-tetramethylphenyl)sulfonylpiperazin-1-yl]-4-thiophen-2-ylbutan-1-one Traditional Name: 1-[4-(2,3,5,6-tetramethylphenyl)sulfonylpiperazino]-4-(2-thienyl)butan-1-one Formula: C22H30N2O3S2 MolecularWeight: 434.6152

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C)S(=O)(=O)N2CCN(CC2)C(=O)CCCC3=CC=CS3)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1C)S(=O)(=O)N2CCN(CC2)C(=O)CCCC3=CC=CS3)C)C

InChI

InChI=1S/C22H30N2O3S2/c1-16-15-17(2)19(4)22(18(16)3)29(26,27)24-12-10-23(11-13-24)21(25)9-5-7-20-8-6-14-28-20/h6,8,14-15H,5,7,9-13H2,1-4H3