methyl 3-phenyl-2-(1,3-thiazol-2-ylcarbamothioylamino)propanoate

Systemtic Name: methyl 3-phenyl-2-(1,3-thiazol-2-ylcarbamothioylamino)propanoate Openeye Name: methyl 3-phenyl-2-(thiazol-2-ylcarbamothioylamino)propanoate CAS Name: 3-phenyl-2-[[sulfanylidene-(2-thiazolylamino)methyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-phenyl-2-(1,3-thiazol-2-ylcarbamothioylamino)propanoate Traditional Name: 3-phenyl-2-(thiazol-2-ylthiocarbamoylamino)propionic acid methyl ester Formula: C14H15N3O2S2 MolecularWeight: 321.4178

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=CC=C1)NC(=S)NC2=NC=CS2

Isomeric SMILES

COC(=O)C(CC1=CC=CC=C1)NC(=S)NC2=NC=CS2

InChI

InChI=1S/C14H15N3O2S2/c1-19-12(18)11(9-10-5-3-2-4-6-10)16-13(20)17-14-15-7-8-21-14/h2-8,11H,9H2,1H3,(H2,15,16,17,20)