1-ethyl-4-isothiocyanato-piperidin-2-one

Systemtic Name: 1-ethyl-4-isothiocyanato-piperidin-2-one Openeye Name: 1-ethyl-4-isothiocyanato-piperidin-2-one CAS Name: 1-ethyl-4-isothiocyanato-2-piperidinone IUPAC Name: 1-ethyl-4-isothiocyanatopiperidin-2-one Traditional Name: 1-ethyl-4-isothiocyanato-2-piperidone Formula: C8H12N2OS MolecularWeight: 184.25868

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CCC(CC1=O)N=C=S

Isomeric SMILES

CCN1CCC(CC1=O)N=C=S

InChI

InChI=1S/C8H12N2OS/c1-2-10-4-3-7(9-6-12)5-8(10)11/h7H,2-5H2,1H3