3-[4-(4-fluorophenyl)piperazin-1-yl]sulfonyl-N-(3-methylbutan-2-yl)benzamide

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H28FN3O3S/c1-16(2)17(3)24-22(27)18-5-4-6-21(15-18)30(28,29)26-13-11-25(12-14-26)20-9-7-19(23)8-10-20/h4-10,15-17H,11-14H2,1-3H3,(H,24,27)