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

Systemtic Name: 5-methyl-2-(3-methylphenyl)-4-(thiomorpholin-4-ium-4-ylmethyl)-1,3-oxazole Openeye Name: 5-methyl-2-(m-tolyl)-4-(thiomorpholin-4-ium-4-ylmethyl)oxazole CAS Name: 5-methyl-2-(3-methylphenyl)-4-(4-thiomorpholin-4-iumylmethyl)oxazole IUPAC Name: 5-methyl-2-(3-methylphenyl)-4-(thiomorpholin-4-ium-4-ylmethyl)-1,3-oxazole Traditional Name: 5-methyl-2-(m-tolyl)-4-(thiomorpholin-4-ium-4-ylmethyl)oxazole Formula: C16H21N2OS+ MolecularWeight: 289.41574

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H20N2OS/c1-12-4-3-5-14(10-12)16-17-15(13(2)19-16)11-18-6-8-20-9-7-18/h3-5,10H,6-9,11H2,1-2H3/p+1