2-methyl-N-[5-(2-oxidanylidenepropylsulfanyl)-1,3,4-thiadiazol-2-yl]benzamide

Systemtic Name: 2-methyl-N-[5-(2-oxidanylidenepropylsulfanyl)-1,3,4-thiadiazol-2-yl]benzamide Openeye Name: N-(5-acetonylsulfanyl-1,3,4-thiadiazol-2-yl)-2-methyl-benzamide CAS Name: 2-methyl-N-[5-(2-oxopropylthio)-1,3,4-thiadiazol-2-yl]benzamide IUPAC Name: 2-methyl-N-[5-(2-oxopropylsulfanyl)-1,3,4-thiadiazol-2-yl]benzamide Traditional Name: N-[5-(acetonylthio)-1,3,4-thiadiazol-2-yl]-2-methyl-benzamide Formula: C13H13N3O2S2 MolecularWeight: 307.39122

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NC2=NN=C(S2)SCC(=O)C

Isomeric SMILES

CC1=CC=CC=C1C(=O)NC2=NN=C(S2)SCC(=O)C

InChI

InChI=1S/C13H13N3O2S2/c1-8-5-3-4-6-10(8)11(18)14-12-15-16-13(20-12)19-7-9(2)17/h3-6H,7H2,1-2H3,(H,14,15,18)