1-[3-[(3-methoxyphenyl)methyl]-1,2,4-thiadiazol-5-yl]-N-pentyl-piperidine-4-carboxamide

Systemtic Name: 1-[3-[(3-methoxyphenyl)methyl]-1,2,4-thiadiazol-5-yl]-N-pentyl-piperidine-4-carboxamide Openeye Name: 1-[3-[(3-methoxyphenyl)methyl]-1,2,4-thiadiazol-5-yl]-N-pentyl-piperidine-4-carboxamide CAS Name: 1-[3-[(3-methoxyphenyl)methyl]-1,2,4-thiadiazol-5-yl]-N-pentyl-4-piperidinecarboxamide IUPAC Name: 1-[3-[(3-methoxyphenyl)methyl]-1,2,4-thiadiazol-5-yl]-N-pentylpiperidine-4-carboxamide Traditional Name: N-amyl-1-(3-m-anisyl-1,2,4-thiadiazol-5-yl)isonipecotamide Formula: C21H30N4O2S MolecularWeight: 402.5535

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)C1CCN(CC1)C2=NC(=NS2)CC3=CC(=CC=C3)OC

Isomeric SMILES

CCCCCNC(=O)C1CCN(CC1)C2=NC(=NS2)CC3=CC(=CC=C3)OC

InChI

InChI=1S/C21H30N4O2S/c1-3-4-5-11-22-20(26)17-9-12-25(13-10-17)21-23-19(24-28-21)15-16-7-6-8-18(14-16)27-2/h6-8,14,17H,3-5,9-13,15H2,1-2H3,(H,22,26)