4-[[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]methyl]-5-methyl-2-(5-methylthiophen-2-yl)-1,3-oxazole

Systemtic Name: 4-[[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]methyl]-5-methyl-2-(5-methylthiophen-2-yl)-1,3-oxazole Openeye Name: 4-[[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]methyl]-5-methyl-2-(5-methyl-2-thienyl)oxazole CAS Name: 4-[[4-(2-ethoxyphenyl)-1-piperazin-1-iumyl]methyl]-5-methyl-2-(5-methyl-2-thiophenyl)oxazole IUPAC Name: 4-[[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]methyl]-5-methyl-2-(5-methylthiophen-2-yl)-1,3-oxazole Traditional Name: 5-methyl-2-(5-methyl-2-thienyl)-4-[(4-o-phenetylpiperazin-1-ium-1-yl)methyl]oxazole Formula: C22H28N3O2S+ MolecularWeight: 398.54162

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2CC[NH+](CC2)CC3=C(OC(=N3)C4=CC=C(S4)C)C

Isomeric SMILES

CCOC1=CC=CC=C1N2CC[NH+](CC2)CC3=C(OC(=N3)C4=CC=C(S4)C)C

InChI

InChI=1S/C22H27N3O2S/c1-4-26-20-8-6-5-7-19(20)25-13-11-24(12-14-25)15-18-17(3)27-22(23-18)21-10-9-16(2)28-21/h5-10H,4,11-15H2,1-3H3/p+1