2-(4-methoxyphenyl)-5-(4-methylpiperazin-4-ium-1-yl)-4-(phenylsulfonyl)-1,3-oxazole

Systemtic Name: 2-(4-methoxyphenyl)-5-(4-methylpiperazin-4-ium-1-yl)-4-(phenylsulfonyl)-1,3-oxazole Openeye Name: 4-(benzenesulfonyl)-2-(4-methoxyphenyl)-5-(4-methylpiperazin-4-ium-1-yl)oxazole CAS Name: 4-(benzenesulfonyl)-2-(4-methoxyphenyl)-5-(4-methyl-1-piperazin-4-iumyl)oxazole IUPAC Name: 4-(benzenesulfonyl)-2-(4-methoxyphenyl)-5-(4-methylpiperazin-4-ium-1-yl)-1,3-oxazole Traditional Name: 4-besyl-2-(4-methoxyphenyl)-5-(4-methylpiperazin-4-ium-1-yl)oxazole Formula: C21H24N3O4S+ MolecularWeight: 414.49796

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23N3O4S/c1-23-12-14-24(15-13-23)21-20(29(25,26)18-6-4-3-5-7-18)22-19(28-21)16-8-10-17(27-2)11-9-16/h3-11H,12-15H2,1-2H3/p+1