N-[[5-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]furan-2-yl]methyl]-1-pyrimidin-2-yl-piperidin-3-amine

Systemtic Name: N-[[5-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]furan-2-yl]methyl]-1-pyrimidin-2-yl-piperidin-3-amine Openeye Name: N-[[5-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-2-furyl]methyl]-1-pyrimidin-2-yl-piperidin-3-amine CAS Name: N-[[5-[(4-methyl-1,2,4-triazol-3-yl)thio]-2-furanyl]methyl]-1-(2-pyrimidinyl)-3-piperidinamine IUPAC Name: N-[[5-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]furan-2-yl]methyl]-1-pyrimidin-2-ylpiperidin-3-amine Traditional Name: [5-[(4-methyl-1,2,4-triazol-3-yl)thio]-2-furyl]methyl-[1-(2-pyrimidyl)-3-piperidyl]amine Formula: C17H21N7OS MolecularWeight: 371.45994

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=NN=C1SC2=CC=C(O2)CNC3CCCN(C3)C4=NC=CC=N4

Isomeric SMILES

CN1C=NN=C1SC2=CC=C(O2)CNC3CCCN(C3)C4=NC=CC=N4

InChI

InChI=1S/C17H21N7OS/c1-23-12-21-22-17(23)26-15-6-5-14(25-15)10-20-13-4-2-9-24(11-13)16-18-7-3-8-19-16/h3,5-8,12-13,20H,2,4,9-11H2,1H3