N-[3-[4-(2-fluorophenyl)piperazin-1-yl]sulfonylpropyl]-3,5-dimethyl-benzamide

Systemtic Name: N-[3-[4-(2-fluorophenyl)piperazin-1-yl]sulfonylpropyl]-3,5-dimethyl-benzamide Openeye Name: N-[3-[4-(2-fluorophenyl)piperazin-1-yl]sulfonylpropyl]-3,5-dimethyl-benzamide CAS Name: N-[3-[[4-(2-fluorophenyl)-1-piperazinyl]sulfonyl]propyl]-3,5-dimethylbenzamide IUPAC Name: N-[3-[4-(2-fluorophenyl)piperazin-1-yl]sulfonylpropyl]-3,5-dimethylbenzamide Traditional Name: N-[3-[4-(2-fluorophenyl)piperazino]sulfonylpropyl]-3,5-dimethyl-benzamide Formula: C22H28FN3O3S MolecularWeight: 433.539423

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C(=O)NCCCS(=O)(=O)N2CCN(CC2)C3=CC=CC=C3F)C

Isomeric SMILES

CC1=CC(=CC(=C1)C(=O)NCCCS(=O)(=O)N2CCN(CC2)C3=CC=CC=C3F)C

InChI

InChI=1S/C22H28FN3O3S/c1-17-14-18(2)16-19(15-17)22(27)24-8-5-13-30(28,29)26-11-9-25(10-12-26)21-7-4-3-6-20(21)23/h3-4,6-7,14-16H,5,8-13H2,1-2H3,(H,24,27)