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

Systemtic Name: N-(cyanomethyl)-2-[[5-(2-methylpropylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-N-phenyl-ethanamide Openeye Name: N-(cyanomethyl)-2-[[5-(isobutylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-N-phenyl-acetamide CAS Name: N-(cyanomethyl)-2-[[5-(2-methylpropylamino)-1,3,4-thiadiazol-2-yl]thio]-N-phenylacetamide IUPAC Name: N-(cyanomethyl)-2-[[5-(2-methylpropylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-N-phenylacetamide Traditional Name: N-(cyanomethyl)-2-[[5-(isobutylamino)-1,3,4-thiadiazol-2-yl]thio]-N-phenyl-acetamide Formula: C16H19N5OS2 MolecularWeight: 361.48496

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC1=NN=C(S1)SCC(=O)N(CC#N)C2=CC=CC=C2

Isomeric SMILES

CC(C)CNC1=NN=C(S1)SCC(=O)N(CC#N)C2=CC=CC=C2

InChI

InChI=1S/C16H19N5OS2/c1-12(2)10-18-15-19-20-16(24-15)23-11-14(22)21(9-8-17)13-6-4-3-5-7-13/h3-7,12H,9-11H2,1-2H3,(H,18,19)