2-[[5-[4-(diethylamino)phenyl]-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]-N-pentan-3-yl-ethanamide

Systemtic Name: 2-[[5-[4-(diethylamino)phenyl]-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]-N-pentan-3-yl-ethanamide Openeye Name: 2-[[5-[4-(diethylamino)phenyl]-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]-N-(1-ethylpropyl)acetamide CAS Name: 2-[[5-[4-(diethylamino)phenyl]-4-ethyl-1,2,4-triazol-3-yl]thio]-N-pentan-3-ylacetamide IUPAC Name: 2-[[5-[4-(diethylamino)phenyl]-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]-N-pentan-3-ylacetamide Traditional Name: 2-[[5-[4-(diethylamino)phenyl]-4-ethyl-1,2,4-triazol-3-yl]thio]-N-(1-ethylpropyl)acetamide Formula: C21H33N5OS MolecularWeight: 403.58462

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC(=O)CSC1=NN=C(N1CC)C2=CC=C(C=C2)N(CC)CC

Isomeric SMILES

CCC(CC)NC(=O)CSC1=NN=C(N1CC)C2=CC=C(C=C2)N(CC)CC

InChI

InChI=1S/C21H33N5OS/c1-6-17(7-2)22-19(27)15-28-21-24-23-20(26(21)10-5)16-11-13-18(14-12-16)25(8-3)9-4/h11-14,17H,6-10,15H2,1-5H3,(H,22,27)