2-[(5-azanyl-1,3,4-thiadiazol-2-yl)sulfanyl]-N-[4-(cyanomethyl)phenyl]ethanamide

Systemtic Name: 2-[(5-azanyl-1,3,4-thiadiazol-2-yl)sulfanyl]-N-[4-(cyanomethyl)phenyl]ethanamide Openeye Name: 2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]-N-[4-(cyanomethyl)phenyl]acetamide CAS Name: 2-[(5-amino-1,3,4-thiadiazol-2-yl)thio]-N-[4-(cyanomethyl)phenyl]acetamide IUPAC Name: 2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]-N-[4-(cyanomethyl)phenyl]acetamide Traditional Name: 2-[(5-amino-1,3,4-thiadiazol-2-yl)thio]-N-[4-(cyanomethyl)phenyl]acetamide Formula: C12H11N5OS2 MolecularWeight: 305.37864

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC#N)NC(=O)CSC2=NN=C(S2)N

Isomeric SMILES

C1=CC(=CC=C1CC#N)NC(=O)CSC2=NN=C(S2)N

InChI

InChI=1S/C12H11N5OS2/c13-6-5-8-1-3-9(4-2-8)15-10(18)7-19-12-17-16-11(14)20-12/h1-4H,5,7H2,(H2,14,16)(H,15,18)