N-(2-chloranyl-5-methyl-phenyl)-4-(4-pyrimidin-5-ylphenyl)sulfonyl-piperidine-1-carboxamide

Systemtic Name: N-(2-chloranyl-5-methyl-phenyl)-4-(4-pyrimidin-5-ylphenyl)sulfonyl-piperidine-1-carboxamide Openeye Name: N-(2-chloro-5-methyl-phenyl)-4-(4-pyrimidin-5-ylphenyl)sulfonyl-piperidine-1-carboxamide CAS Name: N-(2-chloro-5-methylphenyl)-4-[4-(5-pyrimidinyl)phenyl]sulfonyl-1-piperidinecarboxamide IUPAC Name: N-(2-chloro-5-methylphenyl)-4-(4-pyrimidin-5-ylphenyl)sulfonylpiperidine-1-carboxamide Traditional Name: N-(2-chloro-5-methyl-phenyl)-4-[4-(5-pyrimidyl)phenyl]sulfonyl-piperidine-1-carboxamide Formula: C23H23ClN4O3S MolecularWeight: 470.97172

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)Cl)NC(=O)N2CCC(CC2)S(=O)(=O)C3=CC=C(C=C3)C4=CN=CN=C4

Isomeric SMILES

CC1=CC(=C(C=C1)Cl)NC(=O)N2CCC(CC2)S(=O)(=O)C3=CC=C(C=C3)C4=CN=CN=C4

InChI

InChI=1S/C23H23ClN4O3S/c1-16-2-7-21(24)22(12-16)27-23(29)28-10-8-20(9-11-28)32(30,31)19-5-3-17(4-6-19)18-13-25-15-26-14-18/h2-7,12-15,20H,8-11H2,1H3,(H,27,29)