1-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-yl]-4-thiophen-2-yl-butan-1-one

Systemtic Name: 1-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-yl]-4-thiophen-2-yl-butan-1-one Openeye Name: 1-[4-(4-isopropylphenyl)sulfonylpiperazin-1-yl]-4-(2-thienyl)butan-1-one CAS Name: 1-[4-(4-propan-2-ylphenyl)sulfonyl-1-piperazinyl]-4-thiophen-2-yl-1-butanone IUPAC Name: 1-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-yl]-4-thiophen-2-ylbutan-1-one Traditional Name: 1-(4-p-cumenylsulfonylpiperazino)-4-(2-thienyl)butan-1-one Formula: C21H28N2O3S2 MolecularWeight: 420.58862

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CCCC3=CC=CS3

Isomeric SMILES

CC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CCCC3=CC=CS3

InChI

InChI=1S/C21H28N2O3S2/c1-17(2)18-8-10-20(11-9-18)28(25,26)23-14-12-22(13-15-23)21(24)7-3-5-19-6-4-16-27-19/h4,6,8-11,16-17H,3,5,7,12-15H2,1-2H3