ethyl 1-(3-imidazo[1,2-a]pyrimidin-2-ylphenyl)sulfonylpiperidine-4-carboxylate

Systemtic Name: ethyl 1-(3-imidazo[1,2-a]pyrimidin-2-ylphenyl)sulfonylpiperidine-4-carboxylate Openeye Name: ethyl 1-(3-imidazo[1,2-a]pyrimidin-2-ylphenyl)sulfonylpiperidine-4-carboxylate CAS Name: 1-[3-(2-imidazo[1,2-a]pyrimidinyl)phenyl]sulfonyl-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(3-imidazo[1,2-a]pyrimidin-2-ylphenyl)sulfonylpiperidine-4-carboxylate Traditional Name: 1-(3-imidazo[1,2-a]pyrimidin-2-ylphenyl)sulfonylisonipecotic acid ethyl ester Formula: C20H22N4O4S MolecularWeight: 414.47808

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C3=CN4C=CC=NC4=N3

Isomeric SMILES

CCOC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C3=CN4C=CC=NC4=N3

InChI

InChI=1S/C20H22N4O4S/c1-2-28-19(25)15-7-11-24(12-8-15)29(26,27)17-6-3-5-16(13-17)18-14-23-10-4-9-21-20(23)22-18/h3-6,9-10,13-15H,2,7-8,11-12H2,1H3