N-[5-[(phenylmethylsulfanyl)methyl]-1,3,4-thiadiazol-2-yl]ethanamide

Systemtic Name: N-[5-[(phenylmethylsulfanyl)methyl]-1,3,4-thiadiazol-2-yl]ethanamide Openeye Name: N-[5-(benzylsulfanylmethyl)-1,3,4-thiadiazol-2-yl]acetamide CAS Name: N-[5-[(phenylmethylthio)methyl]-1,3,4-thiadiazol-2-yl]acetamide IUPAC Name: N-[5-(benzylsulfanylmethyl)-1,3,4-thiadiazol-2-yl]acetamide Traditional Name: N-[5-[(benzylthio)methyl]-1,3,4-thiadiazol-2-yl]acetamide Formula: C12H13N3OS2 MolecularWeight: 279.38112

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NN=C(S1)CSCC2=CC=CC=C2

Isomeric SMILES

CC(=O)NC1=NN=C(S1)CSCC2=CC=CC=C2

InChI

InChI=1S/C12H13N3OS2/c1-9(16)13-12-15-14-11(18-12)8-17-7-10-5-3-2-4-6-10/h2-6H,7-8H2,1H3,(H,13,15,16)