methyl 2-methyl-2-[[4-(1,3-thiazol-4-ylmethylsulfanyl)phenyl]carbonylamino]propanoate

Systemtic Name: methyl 2-methyl-2-[[4-(1,3-thiazol-4-ylmethylsulfanyl)phenyl]carbonylamino]propanoate Openeye Name: methyl 2-methyl-2-[[4-(thiazol-4-ylmethylsulfanyl)benzoyl]amino]propanoate CAS Name: 2-methyl-2-[[oxo-[4-(4-thiazolylmethylthio)phenyl]methyl]amino]propanoic acid methyl ester IUPAC Name: methyl 2-methyl-2-[[4-(1,3-thiazol-4-ylmethylsulfanyl)benzoyl]amino]propanoate Traditional Name: 2-methyl-2-[[4-(thiazol-4-ylmethylthio)benzoyl]amino]propionic acid methyl ester Formula: C16H18N2O3S2 MolecularWeight: 350.45572

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)OC)NC(=O)C1=CC=C(C=C1)SCC2=CSC=N2

Isomeric SMILES

CC(C)(C(=O)OC)NC(=O)C1=CC=C(C=C1)SCC2=CSC=N2

InChI

InChI=1S/C16H18N2O3S2/c1-16(2,15(20)21-3)18-14(19)11-4-6-13(7-5-11)23-9-12-8-22-10-17-12/h4-8,10H,9H2,1-3H3,(H,18,19)