(3S)-N-hexyl-1-[3-(phenylmethyl)-1,2,4-thiadiazol-5-yl]piperidine-3-carboxamide

Systemtic Name: (3S)-N-hexyl-1-[3-(phenylmethyl)-1,2,4-thiadiazol-5-yl]piperidine-3-carboxamide Openeye Name: (3S)-1-(3-benzyl-1,2,4-thiadiazol-5-yl)-N-hexyl-piperidine-3-carboxamide CAS Name: (3S)-N-hexyl-1-[3-(phenylmethyl)-1,2,4-thiadiazol-5-yl]-3-piperidinecarboxamide IUPAC Name: (3S)-1-(3-benzyl-1,2,4-thiadiazol-5-yl)-N-hexylpiperidine-3-carboxamide Traditional Name: (3S)-1-(3-benzyl-1,2,4-thiadiazol-5-yl)-N-hexyl-nipecotamide Formula: C21H30N4OS MolecularWeight: 386.5541

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(=O)C1CCCN(C1)C2=NC(=NS2)CC3=CC=CC=C3

Isomeric SMILES

CCCCCCNC(=O)[C@H]1CCCN(C1)C2=NC(=NS2)CC3=CC=CC=C3

InChI

InChI=1S/C21H30N4OS/c1-2-3-4-8-13-22-20(26)18-12-9-14-25(16-18)21-23-19(24-27-21)15-17-10-6-5-7-11-17/h5-7,10-11,18H,2-4,8-9,12-16H2,1H3,(H,22,26)/t18-/m0/s1