methyl (2R)-4-methyl-2-[2-[(4-phenyl-1,3-thiazol-2-yl)sulfanyl]ethanoylamino]pentanoate

Systemtic Name: methyl (2R)-4-methyl-2-[2-[(4-phenyl-1,3-thiazol-2-yl)sulfanyl]ethanoylamino]pentanoate Openeye Name: methyl (2R)-4-methyl-2-[[2-(4-phenylthiazol-2-yl)sulfanylacetyl]amino]pentanoate CAS Name: (2R)-4-methyl-2-[[1-oxo-2-[(4-phenyl-2-thiazolyl)thio]ethyl]amino]pentanoic acid methyl ester IUPAC Name: methyl (2R)-4-methyl-2-[[2-[(4-phenyl-1,3-thiazol-2-yl)sulfanyl]acetyl]amino]pentanoate Traditional Name: (2R)-4-methyl-2-[[2-[(4-phenylthiazol-2-yl)thio]acetyl]amino]valeric acid methyl ester Formula: C18H22N2O3S2 MolecularWeight: 378.50888

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OC)NC(=O)CSC1=NC(=CS1)C2=CC=CC=C2

Isomeric SMILES

CC(C)C[C@H](C(=O)OC)NC(=O)CSC1=NC(=CS1)C2=CC=CC=C2

InChI

InChI=1S/C18H22N2O3S2/c1-12(2)9-14(17(22)23-3)19-16(21)11-25-18-20-15(10-24-18)13-7-5-4-6-8-13/h4-8,10,12,14H,9,11H2,1-3H3,(H,19,21)/t14-/m1/s1