1-[4-(5-methylthiophen-2-yl)sulfonylpiperazin-1-yl]-3-(3,4,5-trimethoxyphenyl)propan-1-one

Systemtic Name: 1-[4-(5-methylthiophen-2-yl)sulfonylpiperazin-1-yl]-3-(3,4,5-trimethoxyphenyl)propan-1-one Openeye Name: 1-[4-[(5-methyl-2-thienyl)sulfonyl]piperazin-1-yl]-3-(3,4,5-trimethoxyphenyl)propan-1-one CAS Name: 1-[4-[(5-methyl-2-thiophenyl)sulfonyl]-1-piperazinyl]-3-(3,4,5-trimethoxyphenyl)-1-propanone IUPAC Name: 1-[4-(5-methylthiophen-2-yl)sulfonylpiperazin-1-yl]-3-(3,4,5-trimethoxyphenyl)propan-1-one Traditional Name: 1-[4-[(5-methyl-2-thienyl)sulfonyl]piperazino]-3-(3,4,5-trimethoxyphenyl)propan-1-one Formula: C21H28N2O6S2 MolecularWeight: 468.58682

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)S(=O)(=O)N2CCN(CC2)C(=O)CCC3=CC(=C(C(=C3)OC)OC)OC

Isomeric SMILES

CC1=CC=C(S1)S(=O)(=O)N2CCN(CC2)C(=O)CCC3=CC(=C(C(=C3)OC)OC)OC

InChI

InChI=1S/C21H28N2O6S2/c1-15-5-8-20(30-15)31(25,26)23-11-9-22(10-12-23)19(24)7-6-16-13-17(27-2)21(29-4)18(14-16)28-3/h5,8,13-14H,6-7,9-12H2,1-4H3