2-methylbutyl 2-[(5-phenyl-1,3,4-thiadiazol-2-yl)sulfanyl]propanoate

Systemtic Name: 2-methylbutyl 2-[(5-phenyl-1,3,4-thiadiazol-2-yl)sulfanyl]propanoate Openeye Name: 2-methylbutyl 2-[(5-phenyl-1,3,4-thiadiazol-2-yl)sulfanyl]propanoate CAS Name: 2-[(5-phenyl-1,3,4-thiadiazol-2-yl)thio]propanoic acid 2-methylbutyl ester IUPAC Name: 2-methylbutyl 2-[(5-phenyl-1,3,4-thiadiazol-2-yl)sulfanyl]propanoate Traditional Name: 2-[(5-phenyl-1,3,4-thiadiazol-2-yl)thio]propionic acid 2-methylbutyl ester Formula: C16H20N2O2S2 MolecularWeight: 336.4722

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)COC(=O)C(C)SC1=NN=C(S1)C2=CC=CC=C2

Isomeric SMILES

CCC(C)COC(=O)C(C)SC1=NN=C(S1)C2=CC=CC=C2

InChI

InChI=1S/C16H20N2O2S2/c1-4-11(2)10-20-15(19)12(3)21-16-18-17-14(22-16)13-8-6-5-7-9-13/h5-9,11-12H,4,10H2,1-3H3