5-methyl-2-phenyl-4-[[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-ium-1-yl]methyl]-1,3-oxazole

Systemtic Name: 5-methyl-2-phenyl-4-[[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-ium-1-yl]methyl]-1,3-oxazole Openeye Name: 4-[[4-(4-isopropylphenyl)sulfonylpiperazin-1-ium-1-yl]methyl]-5-methyl-2-phenyl-oxazole CAS Name: 5-methyl-2-phenyl-4-[[4-(4-propan-2-ylphenyl)sulfonyl-1-piperazin-1-iumyl]methyl]oxazole IUPAC Name: 5-methyl-2-phenyl-4-[[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-ium-1-yl]methyl]-1,3-oxazole Traditional Name: 5-methyl-4-[(4-p-cumenylsulfonylpiperazin-1-ium-1-yl)methyl]-2-phenyl-oxazole Formula: C24H30N3O3S+ MolecularWeight: 440.5783

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(O1)C2=CC=CC=C2)C[NH+]3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)C(C)C

Isomeric SMILES

CC1=C(N=C(O1)C2=CC=CC=C2)C[NH+]3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)C(C)C

InChI

InChI=1S/C24H29N3O3S/c1-18(2)20-9-11-22(12-10-20)31(28,29)27-15-13-26(14-16-27)17-23-19(3)30-24(25-23)21-7-5-4-6-8-21/h4-12,18H,13-17H2,1-3H3/p+1