[(2R)-1-(aminocarbonylamino)-3-methyl-1-oxidanylidene-butan-2-yl] 2-(1,3-benzothiazol-2-ylmethoxy)ethanoate

Systemtic Name: [(2R)-1-(aminocarbonylamino)-3-methyl-1-oxidanylidene-butan-2-yl] 2-(1,3-benzothiazol-2-ylmethoxy)ethanoate Openeye Name: [(1R)-1-allophanoyl-2-methyl-propyl] 2-(1,3-benzothiazol-2-ylmethoxy)acetate CAS Name: 2-(1,3-benzothiazol-2-ylmethoxy)acetic acid [(2R)-1-(carbamoylamino)-3-methyl-1-oxobutan-2-yl] ester IUPAC Name: [(2R)-1-(carbamoylamino)-3-methyl-1-oxobutan-2-yl] 2-(1,3-benzothiazol-2-ylmethoxy)acetate Traditional Name: 2-(1,3-benzothiazol-2-ylmethoxy)acetic acid [(1R)-1-allophanoyl-2-methyl-propyl] ester Formula: C16H19N3O5S MolecularWeight: 365.40416

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC(=O)N)OC(=O)COCC1=NC2=CC=CC=C2S1

Isomeric SMILES

CC(C)[C@H](C(=O)NC(=O)N)OC(=O)COCC1=NC2=CC=CC=C2S1

InChI

InChI=1S/C16H19N3O5S/c1-9(2)14(15(21)19-16(17)22)24-13(20)8-23-7-12-18-10-5-3-4-6-11(10)25-12/h3-6,9,14H,7-8H2,1-2H3,(H3,17,19,21,22)/t14-/m1/s1