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

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

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

Isomeric SMILES

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

InChI

InChI=1S/C18H22N2O3S2/c1-4-12(2)16(17(22)23-3)20-15(21)11-25-18-19-14(10-24-18)13-8-6-5-7-9-13/h5-10,12,16H,4,11H2,1-3H3,(H,20,21)