N-(2-phenylpyrimidin-5-yl)-1-(phenylsulfonyl)piperidine-4-carboxamide

Systemtic Name: N-(2-phenylpyrimidin-5-yl)-1-(phenylsulfonyl)piperidine-4-carboxamide Openeye Name: 1-(benzenesulfonyl)-N-(2-phenylpyrimidin-5-yl)piperidine-4-carboxamide CAS Name: 1-(benzenesulfonyl)-N-(2-phenyl-5-pyrimidinyl)-4-piperidinecarboxamide IUPAC Name: 1-(benzenesulfonyl)-N-(2-phenylpyrimidin-5-yl)piperidine-4-carboxamide Traditional Name: 1-besyl-N-(2-phenylpyrimidin-5-yl)isonipecotamide Formula: C22H22N4O3S MolecularWeight: 422.50008

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CN=C(N=C2)C3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CN=C(N=C2)C3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H22N4O3S/c27-22(25-19-15-23-21(24-16-19)17-7-3-1-4-8-17)18-11-13-26(14-12-18)30(28,29)20-9-5-2-6-10-20/h1-10,15-16,18H,11-14H2,(H,25,27)