1-(4-methylphenyl)sulfonyl-3-(4-sulfanylidenemorpholin-4-ium-2-yl)urea

Systemtic Name: 1-(4-methylphenyl)sulfonyl-3-(4-sulfanylidenemorpholin-4-ium-2-yl)urea Openeye Name: 1-(p-tolylsulfonyl)-3-(4-thioxomorpholin-4-ium-2-yl)urea CAS Name: 1-(4-methylphenyl)sulfonyl-3-(4-sulfanylidene-2-morpholin-4-iumyl)urea IUPAC Name: 1-(4-methylphenyl)sulfonyl-3-(4-sulfanylidenemorpholin-4-ium-2-yl)urea Traditional Name: 1-(4-thioxomorpholin-4-ium-2-yl)-3-tosyl-urea Formula: C12H16N3O4S2+ MolecularWeight: 330.40314

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(=O)NC2C[N+](=S)CCO2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(=O)NC2C[N+](=S)CCO2

InChI

InChI=1S/C12H15N3O4S2/c1-9-2-4-10(5-3-9)21(17,18)14-12(16)13-11-8-15(20)6-7-19-11/h2-5,11H,6-8H2,1H3,(H-,13,14,16)/p+1