2-[2-[2-(methoxycarbonylamino)-1,3-thiazol-4-yl]ethanoylamino]-3-methyl-butanoic acid

Systemtic Name: 2-[2-[2-(methoxycarbonylamino)-1,3-thiazol-4-yl]ethanoylamino]-3-methyl-butanoic acid Openeye Name: 2-[[2-[2-(methoxycarbonylamino)thiazol-4-yl]acetyl]amino]-3-methyl-butanoic acid CAS Name: 2-[[2-[2-(methoxycarbonylamino)-4-thiazolyl]-1-oxoethyl]amino]-3-methylbutanoic acid IUPAC Name: 2-[[2-[2-(methoxycarbonylamino)-1,3-thiazol-4-yl]acetyl]amino]-3-methylbutanoic acid Traditional Name: 2-[[2-[2-(carbomethoxyamino)thiazol-4-yl]acetyl]amino]-3-methyl-butyric acid Formula: C12H17N3O5S MolecularWeight: 315.34548

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NC(=O)CC1=CSC(=N1)NC(=O)OC

Isomeric SMILES

CC(C)C(C(=O)O)NC(=O)CC1=CSC(=N1)NC(=O)OC

InChI

InChI=1S/C12H17N3O5S/c1-6(2)9(10(17)18)14-8(16)4-7-5-21-11(13-7)15-12(19)20-3/h5-6,9H,4H2,1-3H3,(H,14,16)(H,17,18)(H,13,15,19)