2,4,6-triethoxy-N-[5-(1-methoxy-3-methyl-pentan-3-yl)-1,3,4-thiadiazol-2-yl]benzenecarbothioamide

Systemtic Name: 2,4,6-triethoxy-N-[5-(1-methoxy-3-methyl-pentan-3-yl)-1,3,4-thiadiazol-2-yl]benzenecarbothioamide Openeye Name: 2,4,6-triethoxy-N-[5-(1-ethyl-3-methoxy-1-methyl-propyl)-1,3,4-thiadiazol-2-yl]benzenecarbothioamide CAS Name: 2,4,6-triethoxy-N-[5-(1-methoxy-3-methylpentan-3-yl)-1,3,4-thiadiazol-2-yl]benzenecarbothioamide IUPAC Name: 2,4,6-triethoxy-N-[5-(1-methoxy-3-methylpentan-3-yl)-1,3,4-thiadiazol-2-yl]benzenecarbothioamide Traditional Name: 2,4,6-triethoxy-N-[5-(1-ethyl-3-methoxy-1-methyl-propyl)-1,3,4-thiadiazol-2-yl]thiobenzamide Formula: C22H33N3O4S2 MolecularWeight: 467.64512

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(CCOC)C1=NN=C(S1)NC(=S)C2=C(C=C(C=C2OCC)OCC)OCC

Isomeric SMILES

CCC(C)(CCOC)C1=NN=C(S1)NC(=S)C2=C(C=C(C=C2OCC)OCC)OCC

InChI

InChI=1S/C22H33N3O4S2/c1-7-22(5,11-12-26-6)20-24-25-21(31-20)23-19(30)18-16(28-9-3)13-15(27-8-2)14-17(18)29-10-4/h13-14H,7-12H2,1-6H3,(H,23,25,30)