2-(4-methoxy-3-methyl-phenyl)-5-methyl-4-(thiomorpholin-4-ium-4-ylmethyl)-1,3-oxazole

Systemtic Name: 2-(4-methoxy-3-methyl-phenyl)-5-methyl-4-(thiomorpholin-4-ium-4-ylmethyl)-1,3-oxazole Openeye Name: 2-(4-methoxy-3-methyl-phenyl)-5-methyl-4-(thiomorpholin-4-ium-4-ylmethyl)oxazole CAS Name: 2-(4-methoxy-3-methylphenyl)-5-methyl-4-(4-thiomorpholin-4-iumylmethyl)oxazole IUPAC Name: 2-(4-methoxy-3-methylphenyl)-5-methyl-4-(thiomorpholin-4-ium-4-ylmethyl)-1,3-oxazole Traditional Name: 2-(4-methoxy-3-methyl-phenyl)-5-methyl-4-(thiomorpholin-4-ium-4-ylmethyl)oxazole Formula: C17H23N2O2S+ MolecularWeight: 319.44172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2=NC(=C(O2)C)C[NH+]3CCSCC3)OC

Isomeric SMILES

CC1=C(C=CC(=C1)C2=NC(=C(O2)C)C[NH+]3CCSCC3)OC

InChI

InChI=1S/C17H22N2O2S/c1-12-10-14(4-5-16(12)20-3)17-18-15(13(2)21-17)11-19-6-8-22-9-7-19/h4-5,10H,6-9,11H2,1-3H3/p+1