N-[4-azanyl-5-(2-fluorophenyl)carbonyl-pyrimidin-2-yl]-N-piperidin-4-yl-ethanesulfonamide

Systemtic Name: N-[4-azanyl-5-(2-fluorophenyl)carbonyl-pyrimidin-2-yl]-N-piperidin-4-yl-ethanesulfonamide Openeye Name: N-[4-amino-5-(2-fluorobenzoyl)pyrimidin-2-yl]-N-(4-piperidyl)ethanesulfonamide CAS Name: N-[4-amino-5-[(2-fluorophenyl)-oxomethyl]-2-pyrimidinyl]-N-(4-piperidinyl)ethanesulfonamide IUPAC Name: N-[4-amino-5-(2-fluorobenzoyl)pyrimidin-2-yl]-N-piperidin-4-ylethanesulfonamide Traditional Name: N-[4-amino-5-(2-fluorobenzoyl)pyrimidin-2-yl]-N-(4-piperidyl)ethanesulfonamide Formula: C18H22FN5O3S MolecularWeight: 407.462383

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N(C1CCNCC1)C2=NC=C(C(=N2)N)C(=O)C3=CC=CC=C3F

Isomeric SMILES

CCS(=O)(=O)N(C1CCNCC1)C2=NC=C(C(=N2)N)C(=O)C3=CC=CC=C3F

InChI

InChI=1S/C18H22FN5O3S/c1-2-28(26,27)24(12-7-9-21-10-8-12)18-22-11-14(17(20)23-18)16(25)13-5-3-4-6-15(13)19/h3-6,11-12,21H,2,7-10H2,1H3,(H2,20,22,23)