N-(2-phenoxyphenyl)-4-(4-pyrimidin-5-ylphenyl)sulfonyl-piperidine-1-carboxamide

Systemtic Name: N-(2-phenoxyphenyl)-4-(4-pyrimidin-5-ylphenyl)sulfonyl-piperidine-1-carboxamide Openeye Name: N-(2-phenoxyphenyl)-4-(4-pyrimidin-5-ylphenyl)sulfonyl-piperidine-1-carboxamide CAS Name: N-(2-phenoxyphenyl)-4-[4-(5-pyrimidinyl)phenyl]sulfonyl-1-piperidinecarboxamide IUPAC Name: N-(2-phenoxyphenyl)-4-(4-pyrimidin-5-ylphenyl)sulfonylpiperidine-1-carboxamide Traditional Name: N-(2-phenoxyphenyl)-4-[4-(5-pyrimidyl)phenyl]sulfonyl-piperidine-1-carboxamide Formula: C28H26N4O4S MolecularWeight: 514.59544

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1S(=O)(=O)C2=CC=C(C=C2)C3=CN=CN=C3)C(=O)NC4=CC=CC=C4OC5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1S(=O)(=O)C2=CC=C(C=C2)C3=CN=CN=C3)C(=O)NC4=CC=CC=C4OC5=CC=CC=C5

InChI

InChI=1S/C28H26N4O4S/c33-28(31-26-8-4-5-9-27(26)36-23-6-2-1-3-7-23)32-16-14-25(15-17-32)37(34,35)24-12-10-21(11-13-24)22-18-29-20-30-19-22/h1-13,18-20,25H,14-17H2,(H,31,33)