[(2R)-1-(aminocarbonylamino)-3-methyl-1-oxidanylidene-butan-2-yl] 2-methoxy-4-methylsulfanyl-benzoate

Systemtic Name: [(2R)-1-(aminocarbonylamino)-3-methyl-1-oxidanylidene-butan-2-yl] 2-methoxy-4-methylsulfanyl-benzoate Openeye Name: [(1R)-1-allophanoyl-2-methyl-propyl] 2-methoxy-4-methylsulfanyl-benzoate CAS Name: 2-methoxy-4-(methylthio)benzoic acid [(2R)-1-(carbamoylamino)-3-methyl-1-oxobutan-2-yl] ester IUPAC Name: [(2R)-1-(carbamoylamino)-3-methyl-1-oxobutan-2-yl] 2-methoxy-4-methylsulfanylbenzoate Traditional Name: 2-methoxy-4-(methylthio)benzoic acid [(1R)-1-allophanoyl-2-methyl-propyl] ester Formula: C15H20N2O5S MolecularWeight: 340.3947

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC(=O)N)OC(=O)C1=C(C=C(C=C1)SC)OC

Isomeric SMILES

CC(C)[C@H](C(=O)NC(=O)N)OC(=O)C1=C(C=C(C=C1)SC)OC

InChI

InChI=1S/C15H20N2O5S/c1-8(2)12(13(18)17-15(16)20)22-14(19)10-6-5-9(23-4)7-11(10)21-3/h5-8,12H,1-4H3,(H3,16,17,18,20)/t12-/m1/s1