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

Systemtic Name: 2-[2-[2-(methoxycarbonylamino)-1,3-thiazol-4-yl]ethanoylamino]-4-methyl-pentanoic acid Openeye Name: 2-[[2-[2-(methoxycarbonylamino)thiazol-4-yl]acetyl]amino]-4-methyl-pentanoic acid CAS Name: 2-[[2-[2-(methoxycarbonylamino)-4-thiazolyl]-1-oxoethyl]amino]-4-methylpentanoic acid IUPAC Name: 2-[[2-[2-(methoxycarbonylamino)-1,3-thiazol-4-yl]acetyl]amino]-4-methylpentanoic acid Traditional Name: 2-[[2-[2-(carbomethoxyamino)thiazol-4-yl]acetyl]amino]-4-methyl-valeric acid Formula: C13H19N3O5S MolecularWeight: 329.37206

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H19N3O5S/c1-7(2)4-9(11(18)19)15-10(17)5-8-6-22-12(14-8)16-13(20)21-3/h6-7,9H,4-5H2,1-3H3,(H,15,17)(H,18,19)(H,14,16,20)