2-(phenylmethylsulfanyl)-N-(1,3,4-thiadiazol-2-yl)propanamide

Systemtic Name: 2-(phenylmethylsulfanyl)-N-(1,3,4-thiadiazol-2-yl)propanamide Openeye Name: 2-benzylsulfanyl-N-(1,3,4-thiadiazol-2-yl)propanamide CAS Name: 2-(phenylmethylthio)-N-(1,3,4-thiadiazol-2-yl)propanamide IUPAC Name: 2-benzylsulfanyl-N-(1,3,4-thiadiazol-2-yl)propanamide Traditional Name: 2-(benzylthio)-N-(1,3,4-thiadiazol-2-yl)propionamide Formula: C12H13N3OS2 MolecularWeight: 279.38112

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=NN=CS1)SCC2=CC=CC=C2

Isomeric SMILES

CC(C(=O)NC1=NN=CS1)SCC2=CC=CC=C2

InChI

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