2-[[5-[(2-methylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanyl]ethanamide

Systemtic Name: 2-[[5-[(2-methylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanyl]ethanamide Openeye Name: 2-[[5-(o-tolylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]sulfanyl]acetamide CAS Name: 2-[[5-[(2-methylphenyl)methylthio]-1,3,4-thiadiazol-2-yl]thio]acetamide IUPAC Name: 2-[[5-[(2-methylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanyl]acetamide Traditional Name: 2-[[5-[(2-methylbenzyl)thio]-1,3,4-thiadiazol-2-yl]thio]acetamide Formula: C12H13N3OS3 MolecularWeight: 311.44612

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CSC2=NN=C(S2)SCC(=O)N

Isomeric SMILES

CC1=CC=CC=C1CSC2=NN=C(S2)SCC(=O)N

InChI

InChI=1S/C12H13N3OS3/c1-8-4-2-3-5-9(8)6-17-11-14-15-12(19-11)18-7-10(13)16/h2-5H,6-7H2,1H3,(H2,13,16)