N-[2-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-4-ethoxy-N-(4-fluorophenyl)benzenesulfonamide

Systemtic Name: N-[2-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-4-ethoxy-N-(4-fluorophenyl)benzenesulfonamide Openeye Name: N-[2-[4-(5-chloro-2-methyl-phenyl)piperazin-1-yl]-2-oxo-ethyl]-4-ethoxy-N-(4-fluorophenyl)benzenesulfonamide CAS Name: N-[2-[4-(5-chloro-2-methylphenyl)-1-piperazinyl]-2-oxoethyl]-4-ethoxy-N-(4-fluorophenyl)benzenesulfonamide IUPAC Name: N-[2-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-2-oxoethyl]-4-ethoxy-N-(4-fluorophenyl)benzenesulfonamide Traditional Name: N-[2-[4-(5-chloro-2-methyl-phenyl)piperazino]-2-keto-ethyl]-4-ethoxy-N-(4-fluorophenyl)benzenesulfonamide Formula: C27H29ClFN3O4S MolecularWeight: 546.053263

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)N2CCN(CC2)C3=C(C=CC(=C3)Cl)C)C4=CC=C(C=C4)F

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)N2CCN(CC2)C3=C(C=CC(=C3)Cl)C)C4=CC=C(C=C4)F

InChI

InChI=1S/C27H29ClFN3O4S/c1-3-36-24-10-12-25(13-11-24)37(34,35)32(23-8-6-22(29)7-9-23)19-27(33)31-16-14-30(15-17-31)26-18-21(28)5-4-20(26)2/h4-13,18H,3,14-17,19H2,1-2H3