N-(4-fluorophenyl)-2,2-dimethyl-N-[[6-(4-methylsulfonylpiperazin-1-yl)pyridin-3-yl]methyl]butanamide

Systemtic Name: N-(4-fluorophenyl)-2,2-dimethyl-N-[[6-(4-methylsulfonylpiperazin-1-yl)pyridin-3-yl]methyl]butanamide Openeye Name: N-(4-fluorophenyl)-2,2-dimethyl-N-[[6-(4-methylsulfonylpiperazin-1-yl)-3-pyridyl]methyl]butanamide CAS Name: N-(4-fluorophenyl)-2,2-dimethyl-N-[[6-(4-methylsulfonyl-1-piperazinyl)-3-pyridinyl]methyl]butanamide IUPAC Name: N-(4-fluorophenyl)-2,2-dimethyl-N-[[6-(4-methylsulfonylpiperazin-1-yl)pyridin-3-yl]methyl]butanamide Traditional Name: N-(4-fluorophenyl)-N-[[6-(4-mesylpiperazino)-3-pyridyl]methyl]-2,2-dimethyl-butyramide Formula: C23H31FN4O3S MolecularWeight: 462.580643

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C(=O)N(CC1=CN=C(C=C1)N2CCN(CC2)S(=O)(=O)C)C3=CC=C(C=C3)F

Isomeric SMILES

CCC(C)(C)C(=O)N(CC1=CN=C(C=C1)N2CCN(CC2)S(=O)(=O)C)C3=CC=C(C=C3)F

InChI

InChI=1S/C23H31FN4O3S/c1-5-23(2,3)22(29)28(20-9-7-19(24)8-10-20)17-18-6-11-21(25-16-18)26-12-14-27(15-13-26)32(4,30)31/h6-11,16H,5,12-15,17H2,1-4H3