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

Systemtic Name: 2-chloranyl-N-[5-[(4-methylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]ethanamide Openeye Name: 2-chloro-N-[5-(p-tolylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]acetamide CAS Name: 2-chloro-N-[5-[(4-methylphenyl)methylthio]-1,3,4-thiadiazol-2-yl]acetamide IUPAC Name: 2-chloro-N-[5-[(4-methylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]acetamide Traditional Name: 2-chloro-N-[5-[(4-methylbenzyl)thio]-1,3,4-thiadiazol-2-yl]acetamide Formula: C12H12ClN3OS2 MolecularWeight: 313.82618

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSC2=NN=C(S2)NC(=O)CCl

Isomeric SMILES

CC1=CC=C(C=C1)CSC2=NN=C(S2)NC(=O)CCl

InChI

InChI=1S/C12H12ClN3OS2/c1-8-2-4-9(5-3-8)7-18-12-16-15-11(19-12)14-10(17)6-13/h2-5H,6-7H2,1H3,(H,14,15,17)