5-[(1-cyclohexyl-4,5-dimethyl-imidazol-2-yl)sulfanylmethyl]-N-(phenylmethyl)-1,3,4-thiadiazole-2-carboxamide

Systemtic Name: 5-[(1-cyclohexyl-4,5-dimethyl-imidazol-2-yl)sulfanylmethyl]-N-(phenylmethyl)-1,3,4-thiadiazole-2-carboxamide Openeye Name: N-benzyl-5-[(1-cyclohexyl-4,5-dimethyl-imidazol-2-yl)sulfanylmethyl]-1,3,4-thiadiazole-2-carboxamide CAS Name: 5-[[(1-cyclohexyl-4,5-dimethyl-2-imidazolyl)thio]methyl]-N-(phenylmethyl)-1,3,4-thiadiazole-2-carboxamide IUPAC Name: N-benzyl-5-[(1-cyclohexyl-4,5-dimethylimidazol-2-yl)sulfanylmethyl]-1,3,4-thiadiazole-2-carboxamide Traditional Name: N-benzyl-5-[[(1-cyclohexyl-4,5-dimethyl-imidazol-2-yl)thio]methyl]-1,3,4-thiadiazole-2-carboxamide Formula: C22H27N5OS2 MolecularWeight: 441.61268

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=N1)SCC2=NN=C(S2)C(=O)NCC3=CC=CC=C3)C4CCCCC4)C

Isomeric SMILES

CC1=C(N(C(=N1)SCC2=NN=C(S2)C(=O)NCC3=CC=CC=C3)C4CCCCC4)C

InChI

InChI=1S/C22H27N5OS2/c1-15-16(2)27(18-11-7-4-8-12-18)22(24-15)29-14-19-25-26-21(30-19)20(28)23-13-17-9-5-3-6-10-17/h3,5-6,9-10,18H,4,7-8,11-14H2,1-2H3,(H,23,28)