3-(hydroxymethyl)-N-[(E)-1-pyridin-2-ylethylideneamino]piperidine-1-carbothioamide

Systemtic Name: 3-(hydroxymethyl)-N-[(E)-1-pyridin-2-ylethylideneamino]piperidine-1-carbothioamide Openeye Name: 3-(hydroxymethyl)-N-[(E)-1-(2-pyridyl)ethylideneamino]piperidine-1-carbothioamide CAS Name: 3-(hydroxymethyl)-N-[(E)-1-(2-pyridinyl)ethylideneamino]-1-piperidinecarbothioamide IUPAC Name: 3-(hydroxymethyl)-N-[(E)-1-pyridin-2-ylethylideneamino]piperidine-1-carbothioamide Traditional Name: 3-methylol-N-[(E)-1-(2-pyridyl)ethylideneamino]piperidine-1-carbothioamide Formula: C14H20N4OS MolecularWeight: 292.3998

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=S)N1CCCC(C1)CO)C2=CC=CC=N2

Isomeric SMILES

C/C(=N\NC(=S)N1CCCC(C1)CO)/C2=CC=CC=N2

InChI

InChI=1S/C14H20N4OS/c1-11(13-6-2-3-7-15-13)16-17-14(20)18-8-4-5-12(9-18)10-19/h2-3,6-7,12,19H,4-5,8-10H2,1H3,(H,17,20)/b16-11+