2-[5-(4-fluorophenyl)-3-piperidin-4-yl-imidazol-4-yl]-N-methylsulfanyl-pyrimidin-4-amine

Systemtic Name: 2-[5-(4-fluorophenyl)-3-piperidin-4-yl-imidazol-4-yl]-N-methylsulfanyl-pyrimidin-4-amine Openeye Name: 2-[5-(4-fluorophenyl)-3-(4-piperidyl)imidazol-4-yl]-N-methylsulfanyl-pyrimidin-4-amine CAS Name: N-[2-[5-(4-fluorophenyl)-3-(4-piperidinyl)-4-imidazolyl]-4-pyrimidinyl]methanesulfenamide IUPAC Name: 2-[5-(4-fluorophenyl)-3-piperidin-4-ylimidazol-4-yl]-N-methylsulfanylpyrimidin-4-amine Traditional Name: [2-[5-(4-fluorophenyl)-3-(4-piperidyl)imidazol-4-yl]pyrimidin-4-yl]-(methylthio)amine Formula: C19H21FN6S MolecularWeight: 384.473643

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSNC1=NC(=NC=C1)C2=C(N=CN2C3CCNCC3)C4=CC=C(C=C4)F

Isomeric SMILES

CSNC1=NC(=NC=C1)C2=C(N=CN2C3CCNCC3)C4=CC=C(C=C4)F

InChI

InChI=1S/C19H21FN6S/c1-27-25-16-8-11-22-19(24-16)18-17(13-2-4-14(20)5-3-13)23-12-26(18)15-6-9-21-10-7-15/h2-5,8,11-12,15,21H,6-7,9-10H2,1H3,(H,22,24,25)