4-[4-[(2-chloranyl-4-fluoranyl-phenyl)methyl]piperazin-1-yl]carbonyl-N-prop-2-enyl-benzenesulfonamide

Systemtic Name: 4-[4-[(2-chloranyl-4-fluoranyl-phenyl)methyl]piperazin-1-yl]carbonyl-N-prop-2-enyl-benzenesulfonamide Openeye Name: N-allyl-4-[4-[(2-chloro-4-fluoro-phenyl)methyl]piperazine-1-carbonyl]benzenesulfonamide CAS Name: 4-[[4-[(2-chloro-4-fluorophenyl)methyl]-1-piperazinyl]-oxomethyl]-N-prop-2-enylbenzenesulfonamide IUPAC Name: 4-[4-[(2-chloro-4-fluorophenyl)methyl]piperazine-1-carbonyl]-N-prop-2-enylbenzenesulfonamide Traditional Name: N-allyl-4-[4-(2-chloro-4-fluoro-benzyl)piperazine-1-carbonyl]benzenesulfonamide Formula: C21H23ClFN3O3S MolecularWeight: 451.942023

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNS(=O)(=O)C1=CC=C(C=C1)C(=O)N2CCN(CC2)CC3=C(C=C(C=C3)F)Cl

Isomeric SMILES

C=CCNS(=O)(=O)C1=CC=C(C=C1)C(=O)N2CCN(CC2)CC3=C(C=C(C=C3)F)Cl

InChI

InChI=1S/C21H23ClFN3O3S/c1-2-9-24-30(28,29)19-7-4-16(5-8-19)21(27)26-12-10-25(11-13-26)15-17-3-6-18(23)14-20(17)22/h2-8,14,24H,1,9-13,15H2