[(2R)-1-(aminocarbonylamino)-3-methyl-1-oxidanylidene-butan-2-yl] 2-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]benzoate

Systemtic Name: [(2R)-1-(aminocarbonylamino)-3-methyl-1-oxidanylidene-butan-2-yl] 2-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]benzoate Openeye Name: [(1R)-1-allophanoyl-2-methyl-propyl] 2-[(4-methylthiazol-2-yl)sulfanylmethyl]benzoate CAS Name: 2-[[(4-methyl-2-thiazolyl)thio]methyl]benzoic acid [(2R)-1-(carbamoylamino)-3-methyl-1-oxobutan-2-yl] ester IUPAC Name: [(2R)-1-(carbamoylamino)-3-methyl-1-oxobutan-2-yl] 2-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]benzoate Traditional Name: 2-[[(4-methylthiazol-2-yl)thio]methyl]benzoic acid [(1R)-1-allophanoyl-2-methyl-propyl] ester Formula: C18H21N3O4S2 MolecularWeight: 407.50704

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)SCC2=CC=CC=C2C(=O)OC(C(C)C)C(=O)NC(=O)N

Isomeric SMILES

CC1=CSC(=N1)SCC2=CC=CC=C2C(=O)O[C@H](C(C)C)C(=O)NC(=O)N

InChI

InChI=1S/C18H21N3O4S2/c1-10(2)14(15(22)21-17(19)24)25-16(23)13-7-5-4-6-12(13)9-27-18-20-11(3)8-26-18/h4-8,10,14H,9H2,1-3H3,(H3,19,21,22,24)/t14-/m1/s1