3-(2,5-dimethylphenoxy)-1-(4-thiophen-2-ylsulfonylpiperazin-1-yl)propan-1-one

Systemtic Name: 3-(2,5-dimethylphenoxy)-1-(4-thiophen-2-ylsulfonylpiperazin-1-yl)propan-1-one Openeye Name: 3-(2,5-dimethylphenoxy)-1-[4-(2-thienylsulfonyl)piperazin-1-yl]propan-1-one CAS Name: 3-(2,5-dimethylphenoxy)-1-(4-thiophen-2-ylsulfonyl-1-piperazinyl)-1-propanone IUPAC Name: 3-(2,5-dimethylphenoxy)-1-(4-thiophen-2-ylsulfonylpiperazin-1-yl)propan-1-one Traditional Name: 3-(2,5-dimethylphenoxy)-1-[4-(2-thienylsulfonyl)piperazino]propan-1-one Formula: C19H24N2O4S2 MolecularWeight: 408.53486

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)OCCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

CC1=CC(=C(C=C1)C)OCCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C19H24N2O4S2/c1-15-5-6-16(2)17(14-15)25-12-7-18(22)20-8-10-21(11-9-20)27(23,24)19-4-3-13-26-19/h3-6,13-14H,7-12H2,1-2H3