N-[4-chloranyl-2-(trifluoromethyl)phenyl]-4-methoxy-3-piperazin-1-yl-benzenesulfonamide hydrochloride

Systemtic Name: N-[4-chloranyl-2-(trifluoromethyl)phenyl]-4-methoxy-3-piperazin-1-yl-benzenesulfonamide hydrochloride Openeye Name: N-[4-chloro-2-(trifluoromethyl)phenyl]-4-methoxy-3-piperazin-1-yl-benzenesulfonamide hydrochloride CAS Name: N-[4-chloro-2-(trifluoromethyl)phenyl]-4-methoxy-3-(1-piperazinyl)benzenesulfonamide hydrochloride IUPAC Name: N-[4-chloro-2-(trifluoromethyl)phenyl]-4-methoxy-3-piperazin-1-ylbenzenesulfonamide hydrochloride Traditional Name: N-[4-chloro-2-(trifluoromethyl)phenyl]-4-methoxy-3-piperazino-benzenesulfonamide hydrochloride Formula: C18H20Cl2F3N3O3S MolecularWeight: 486.33591

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)NC2=C(C=C(C=C2)Cl)C(F)(F)F)N3CCNCC3.Cl

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)NC2=C(C=C(C=C2)Cl)C(F)(F)F)N3CCNCC3.Cl

InChI

InChI=1S/C18H19ClF3N3O3S.ClH/c1-28-17-5-3-13(11-16(17)25-8-6-23-7-9-25)29(26,27)24-15-4-2-12(19)10-14(15)18(20,21)22;/h2-5,10-11,23-24H,6-9H2,1H3;1H