S-(5-methylsulfanyl-1,3,4-thiadiazol-2-yl) tridecanethioate

Systemtic Name: S-(5-methylsulfanyl-1,3,4-thiadiazol-2-yl) tridecanethioate Openeye Name: S-(5-methylsulfanyl-1,3,4-thiadiazol-2-yl) tridecanethioate CAS Name: tridecanethioic acid S-[5-(methylthio)-1,3,4-thiadiazol-2-yl] ester IUPAC Name: S-(5-methylsulfanyl-1,3,4-thiadiazol-2-yl) tridecanethioate Traditional Name: tridecanethioic acid S-[5-(methylthio)-1,3,4-thiadiazol-2-yl] ester Formula: C16H28N2OS3 MolecularWeight: 360.60132

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(=O)SC1=NN=C(S1)SC

Isomeric SMILES

CCCCCCCCCCCCC(=O)SC1=NN=C(S1)SC

InChI

InChI=1S/C16H28N2OS3/c1-3-4-5-6-7-8-9-10-11-12-13-14(19)21-16-18-17-15(20-2)22-16/h3-13H2,1-2H3