N-[3-ethyl-5-(phenylmethylsulfanyl)-1,3,4-thiadiazol-2-ylidene]propanamide

Systemtic Name: N-[3-ethyl-5-(phenylmethylsulfanyl)-1,3,4-thiadiazol-2-ylidene]propanamide Openeye Name: N-(5-benzylsulfanyl-3-ethyl-1,3,4-thiadiazol-2-ylidene)propanamide CAS Name: N-[3-ethyl-5-(phenylmethylthio)-1,3,4-thiadiazol-2-ylidene]propanamide IUPAC Name: N-(5-benzylsulfanyl-3-ethyl-1,3,4-thiadiazol-2-ylidene)propanamide Traditional Name: N-[5-(benzylthio)-3-ethyl-1,3,4-thiadiazol-2-ylidene]propionamide Formula: C14H17N3OS2 MolecularWeight: 307.43428

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N=C1N(N=C(S1)SCC2=CC=CC=C2)CC

Isomeric SMILES

CCC(=O)N=C1N(N=C(S1)SCC2=CC=CC=C2)CC

InChI

InChI=1S/C14H17N3OS2/c1-3-12(18)15-13-17(4-2)16-14(20-13)19-10-11-8-6-5-7-9-11/h5-9H,3-4,10H2,1-2H3