ethyl 2-[[5-(3-phenylpropanoylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]propanoate

Systemtic Name: ethyl 2-[[5-(3-phenylpropanoylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]propanoate Openeye Name: ethyl 2-[[5-(3-phenylpropanoylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]propanoate CAS Name: 2-[[5-[(1-oxo-3-phenylpropyl)amino]-1,3,4-thiadiazol-2-yl]thio]propanoic acid ethyl ester IUPAC Name: ethyl 2-[[5-(3-phenylpropanoylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]propanoate Traditional Name: 2-[[5-(hydrocinnamoylamino)-1,3,4-thiadiazol-2-yl]thio]propionic acid ethyl ester Formula: C16H19N3O3S2 MolecularWeight: 365.47036

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)SC1=NN=C(S1)NC(=O)CCC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C(C)SC1=NN=C(S1)NC(=O)CCC2=CC=CC=C2

InChI

InChI=1S/C16H19N3O3S2/c1-3-22-14(21)11(2)23-16-19-18-15(24-16)17-13(20)10-9-12-7-5-4-6-8-12/h4-8,11H,3,9-10H2,1-2H3,(H,17,18,20)