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

Systemtic Name: 5-(4-ethylpiperazin-4-ium-1-yl)-2-(2-methylphenyl)-4-(phenylsulfonyl)-1,3-oxazole Openeye Name: 4-(benzenesulfonyl)-5-(4-ethylpiperazin-4-ium-1-yl)-2-(o-tolyl)oxazole CAS Name: 4-(benzenesulfonyl)-5-(4-ethyl-1-piperazin-4-iumyl)-2-(2-methylphenyl)oxazole IUPAC Name: 4-(benzenesulfonyl)-5-(4-ethylpiperazin-4-ium-1-yl)-2-(2-methylphenyl)-1,3-oxazole Traditional Name: 4-besyl-5-(4-ethylpiperazin-4-ium-1-yl)-2-(o-tolyl)oxazole Formula: C22H26N3O3S+ MolecularWeight: 412.52514

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=C(N=C(O2)C3=CC=CC=C3C)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=C(N=C(O2)C3=CC=CC=C3C)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H25N3O3S/c1-3-24-13-15-25(16-14-24)22-21(29(26,27)18-10-5-4-6-11-18)23-20(28-22)19-12-8-7-9-17(19)2/h4-12H,3,13-16H2,1-2H3/p+1