[1-(aminocarbonylamino)-3-methyl-1-oxidanylidene-butan-2-yl] 2-(2-methylphenyl)sulfanylethanoate

Systemtic Name: [1-(aminocarbonylamino)-3-methyl-1-oxidanylidene-butan-2-yl] 2-(2-methylphenyl)sulfanylethanoate Openeye Name: (1-allophanoyl-2-methyl-propyl) 2-(o-tolylsulfanyl)acetate CAS Name: 2-[(2-methylphenyl)thio]acetic acid [1-(carbamoylamino)-3-methyl-1-oxobutan-2-yl] ester IUPAC Name: [1-(carbamoylamino)-3-methyl-1-oxobutan-2-yl] 2-(2-methylphenyl)sulfanylacetate Traditional Name: 2-(o-tolylthio)acetic acid (1-allophanoyl-2-methyl-propyl) ester Formula: C15H20N2O4S MolecularWeight: 324.3953

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1SCC(=O)OC(C(C)C)C(=O)NC(=O)N

Isomeric SMILES

CC1=CC=CC=C1SCC(=O)OC(C(C)C)C(=O)NC(=O)N

InChI

InChI=1S/C15H20N2O4S/c1-9(2)13(14(19)17-15(16)20)21-12(18)8-22-11-7-5-4-6-10(11)3/h4-7,9,13H,8H2,1-3H3,(H3,16,17,19,20)