N-(4-chloranyl-2-fluoranyl-phenyl)-2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]propanamide

Systemtic Name: N-(4-chloranyl-2-fluoranyl-phenyl)-2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]propanamide Openeye Name: N-(4-chloro-2-fluoro-phenyl)-2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]propanamide CAS Name: N-(4-chloro-2-fluorophenyl)-2-[4-(2,4-dimethylphenyl)sulfonyl-1-piperazinyl]propanamide IUPAC Name: N-(4-chloro-2-fluorophenyl)-2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]propanamide Traditional Name: N-(4-chloro-2-fluoro-phenyl)-2-[4-(2,4-dimethylphenyl)sulfonylpiperazino]propionamide Formula: C21H25ClFN3O3S MolecularWeight: 453.957903

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)N2CCN(CC2)C(C)C(=O)NC3=C(C=C(C=C3)Cl)F)C

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)N2CCN(CC2)C(C)C(=O)NC3=C(C=C(C=C3)Cl)F)C

InChI

InChI=1S/C21H25ClFN3O3S/c1-14-4-7-20(15(2)12-14)30(28,29)26-10-8-25(9-11-26)16(3)21(27)24-19-6-5-17(22)13-18(19)23/h4-7,12-13,16H,8-11H2,1-3H3,(H,24,27)