1-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-3-(4-fluorophenyl)sulfanyl-propan-1-one

Systemtic Name: 1-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-3-(4-fluorophenyl)sulfanyl-propan-1-one Openeye Name: 1-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-3-(4-fluorophenyl)sulfanyl-propan-1-one CAS Name: 1-[4-(3,4-dimethylphenyl)sulfonyl-1-piperazinyl]-3-[(4-fluorophenyl)thio]-1-propanone IUPAC Name: 1-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-3-(4-fluorophenyl)sulfanylpropan-1-one Traditional Name: 1-[4-(3,4-dimethylphenyl)sulfonylpiperazino]-3-[(4-fluorophenyl)thio]propan-1-one Formula: C21H25FN2O3S2 MolecularWeight: 436.563203

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CCSC3=CC=C(C=C3)F)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CCSC3=CC=C(C=C3)F)C

InChI

InChI=1S/C21H25FN2O3S2/c1-16-3-8-20(15-17(16)2)29(26,27)24-12-10-23(11-13-24)21(25)9-14-28-19-6-4-18(22)5-7-19/h3-8,15H,9-14H2,1-2H3