2-methylsulfanyl-N-(5-pentyl-1,3,4-thiadiazol-2-yl)-3-phenyl-imidazole-4-carboxamide

Systemtic Name: 2-methylsulfanyl-N-(5-pentyl-1,3,4-thiadiazol-2-yl)-3-phenyl-imidazole-4-carboxamide Openeye Name: 2-methylsulfanyl-N-(5-pentyl-1,3,4-thiadiazol-2-yl)-3-phenyl-imidazole-4-carboxamide CAS Name: 2-(methylthio)-N-(5-pentyl-1,3,4-thiadiazol-2-yl)-3-phenyl-4-imidazolecarboxamide IUPAC Name: 2-methylsulfanyl-N-(5-pentyl-1,3,4-thiadiazol-2-yl)-3-phenylimidazole-4-carboxamide Traditional Name: N-(5-amyl-1,3,4-thiadiazol-2-yl)-2-(methylthio)-3-phenyl-imidazole-4-carboxamide Formula: C18H21N5OS2 MolecularWeight: 387.52224

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=NN=C(S1)NC(=O)C2=CN=C(N2C3=CC=CC=C3)SC

Isomeric SMILES

CCCCCC1=NN=C(S1)NC(=O)C2=CN=C(N2C3=CC=CC=C3)SC

InChI

InChI=1S/C18H21N5OS2/c1-3-4-6-11-15-21-22-17(26-15)20-16(24)14-12-19-18(25-2)23(14)13-9-7-5-8-10-13/h5,7-10,12H,3-4,6,11H2,1-2H3,(H,20,22,24)