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

Systemtic Name: [(2R)-1-(aminocarbonylamino)-3-methyl-1-oxidanylidene-butan-2-yl] 2-[[(2R)-oxolan-2-yl]methylsulfanyl]benzoate Openeye Name: [(1R)-1-allophanoyl-2-methyl-propyl] 2-[[(2R)-tetrahydrofuran-2-yl]methylsulfanyl]benzoate CAS Name: 2-[[(2R)-2-oxolanyl]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-[[(2R)-oxolan-2-yl]methylsulfanyl]benzoate Traditional Name: 2-[[(2R)-tetrahydrofuran-2-yl]methylthio]benzoic acid [(1R)-1-allophanoyl-2-methyl-propyl] ester Formula: C18H24N2O5S MolecularWeight: 380.45856

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC(=O)N)OC(=O)C1=CC=CC=C1SCC2CCCO2

Isomeric SMILES

CC(C)[C@H](C(=O)NC(=O)N)OC(=O)C1=CC=CC=C1SC[C@H]2CCCO2

InChI

InChI=1S/C18H24N2O5S/c1-11(2)15(16(21)20-18(19)23)25-17(22)13-7-3-4-8-14(13)26-10-12-6-5-9-24-12/h3-4,7-8,11-12,15H,5-6,9-10H2,1-2H3,(H3,19,20,21,23)/t12-,15-/m1/s1