ethyl 2-[1-oxidanylidene-1-[(5-phenyl-1,3,4-thiadiazol-2-yl)amino]butan-2-yl]sulfanylethanoate

Systemtic Name: ethyl 2-[1-oxidanylidene-1-[(5-phenyl-1,3,4-thiadiazol-2-yl)amino]butan-2-yl]sulfanylethanoate Openeye Name: ethyl 2-[1-[(5-phenyl-1,3,4-thiadiazol-2-yl)carbamoyl]propylsulfanyl]acetate CAS Name: 2-[[1-oxo-1-[(5-phenyl-1,3,4-thiadiazol-2-yl)amino]butan-2-yl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[1-oxo-1-[(5-phenyl-1,3,4-thiadiazol-2-yl)amino]butan-2-yl]sulfanylacetate Traditional Name: 2-[1-[(5-phenyl-1,3,4-thiadiazol-2-yl)carbamoyl]propylthio]acetic acid ethyl ester Formula: C16H19N3O3S2 MolecularWeight: 365.47036

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=NN=C(S1)C2=CC=CC=C2)SCC(=O)OCC

Isomeric SMILES

CCC(C(=O)NC1=NN=C(S1)C2=CC=CC=C2)SCC(=O)OCC

InChI

InChI=1S/C16H19N3O3S2/c1-3-12(23-10-13(20)22-4-2)14(21)17-16-19-18-15(24-16)11-8-6-5-7-9-11/h5-9,12H,3-4,10H2,1-2H3,(H,17,19,21)