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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H30N4O2S/c1-3-4-5-11-22-20(26)17-9-7-12-25(15-17)21-23-19(24-28-21)14-16-8-6-10-18(13-16)27-2/h6,8,10,13,17H,3-5,7,9,11-12,14-15H2,1-2H3,(H,22,26)/t17-/m0/s1