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

Systemtic Name: 4-methyl-2-[2-[2-(phenylmethoxycarbonylamino)-1,3-thiazol-4-yl]ethanoylamino]pentanoic acid Openeye Name: 2-[[2-[2-(benzyloxycarbonylamino)thiazol-4-yl]acetyl]amino]-4-methyl-pentanoic acid CAS Name: 4-methyl-2-[[1-oxo-2-[2-(phenylmethoxycarbonylamino)-4-thiazolyl]ethyl]amino]pentanoic acid IUPAC Name: 4-methyl-2-[[2-[2-(phenylmethoxycarbonylamino)-1,3-thiazol-4-yl]acetyl]amino]pentanoic acid Traditional Name: 2-[[2-[2-(benzyloxycarbonylamino)thiazol-4-yl]acetyl]amino]-4-methyl-valeric acid Formula: C19H23N3O5S MolecularWeight: 405.46802

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)NC(=O)CC1=CSC(=N1)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)CC(C(=O)O)NC(=O)CC1=CSC(=N1)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C19H23N3O5S/c1-12(2)8-15(17(24)25)21-16(23)9-14-11-28-18(20-14)22-19(26)27-10-13-6-4-3-5-7-13/h3-7,11-12,15H,8-10H2,1-2H3,(H,21,23)(H,24,25)(H,20,22,26)