2-(4-chlorophenyl)-5-(4-ethylpiperazin-4-ium-1-yl)-4-(4-methylphenyl)sulfonyl-1,3-oxazole

Systemtic Name: 2-(4-chlorophenyl)-5-(4-ethylpiperazin-4-ium-1-yl)-4-(4-methylphenyl)sulfonyl-1,3-oxazole Openeye Name: 2-(4-chlorophenyl)-5-(4-ethylpiperazin-4-ium-1-yl)-4-(p-tolylsulfonyl)oxazole CAS Name: 2-(4-chlorophenyl)-5-(4-ethyl-1-piperazin-4-iumyl)-4-(4-methylphenyl)sulfonyloxazole IUPAC Name: 2-(4-chlorophenyl)-5-(4-ethylpiperazin-4-ium-1-yl)-4-(4-methylphenyl)sulfonyl-1,3-oxazole Traditional Name: 2-(4-chlorophenyl)-5-(4-ethylpiperazin-4-ium-1-yl)-4-tosyl-oxazole Formula: C22H25ClN3O3S+ MolecularWeight: 446.9702

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=C(N=C(O2)C3=CC=C(C=C3)Cl)S(=O)(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=C(N=C(O2)C3=CC=C(C=C3)Cl)S(=O)(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C22H24ClN3O3S/c1-3-25-12-14-26(15-13-25)22-21(30(27,28)19-10-4-16(2)5-11-19)24-20(29-22)17-6-8-18(23)9-7-17/h4-11H,3,12-15H2,1-2H3/p+1