[(2R)-1-(aminocarbonylamino)-3-methyl-1-oxidanylidene-butan-2-yl] 2-(4-bromophenyl)sulfanylethanoate

Systemtic Name: [(2R)-1-(aminocarbonylamino)-3-methyl-1-oxidanylidene-butan-2-yl] 2-(4-bromophenyl)sulfanylethanoate Openeye Name: [(1R)-1-allophanoyl-2-methyl-propyl] 2-(4-bromophenyl)sulfanylacetate CAS Name: 2-[(4-bromophenyl)thio]acetic acid [(2R)-1-(carbamoylamino)-3-methyl-1-oxobutan-2-yl] ester IUPAC Name: [(2R)-1-(carbamoylamino)-3-methyl-1-oxobutan-2-yl] 2-(4-bromophenyl)sulfanylacetate Traditional Name: 2-[(4-bromophenyl)thio]acetic acid [(1R)-1-allophanoyl-2-methyl-propyl] ester Formula: C14H17BrN2O4S MolecularWeight: 389.26478

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC(=O)N)OC(=O)CSC1=CC=C(C=C1)Br

Isomeric SMILES

CC(C)[C@H](C(=O)NC(=O)N)OC(=O)CSC1=CC=C(C=C1)Br

InChI

InChI=1S/C14H17BrN2O4S/c1-8(2)12(13(19)17-14(16)20)21-11(18)7-22-10-5-3-9(15)4-6-10/h3-6,8,12H,7H2,1-2H3,(H3,16,17,19,20)/t12-/m1/s1