N-[(5-ethylthiophen-2-yl)methyl]-1-pyrimidin-2-yl-piperidine-4-carboxamide

Systemtic Name: N-[(5-ethylthiophen-2-yl)methyl]-1-pyrimidin-2-yl-piperidine-4-carboxamide Openeye Name: N-[(5-ethyl-2-thienyl)methyl]-1-pyrimidin-2-yl-piperidine-4-carboxamide CAS Name: N-[(5-ethyl-2-thiophenyl)methyl]-1-(2-pyrimidinyl)-4-piperidinecarboxamide IUPAC Name: N-[(5-ethylthiophen-2-yl)methyl]-1-pyrimidin-2-ylpiperidine-4-carboxamide Traditional Name: N-[(5-ethyl-2-thienyl)methyl]-1-(2-pyrimidyl)isonipecotamide Formula: C17H22N4OS MolecularWeight: 330.44778

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(S1)CNC(=O)C2CCN(CC2)C3=NC=CC=N3

Isomeric SMILES

CCC1=CC=C(S1)CNC(=O)C2CCN(CC2)C3=NC=CC=N3

InChI

InChI=1S/C17H22N4OS/c1-2-14-4-5-15(23-14)12-20-16(22)13-6-10-21(11-7-13)17-18-8-3-9-19-17/h3-5,8-9,13H,2,6-7,10-12H2,1H3,(H,20,22)