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

Systemtic Name: N-(2-methylsulfanylphenyl)-4-(4-pyrimidin-5-ylphenyl)sulfonyl-piperidine-1-carboxamide Openeye Name: N-(2-methylsulfanylphenyl)-4-(4-pyrimidin-5-ylphenyl)sulfonyl-piperidine-1-carboxamide CAS Name: N-[2-(methylthio)phenyl]-4-[4-(5-pyrimidinyl)phenyl]sulfonyl-1-piperidinecarboxamide IUPAC Name: N-(2-methylsulfanylphenyl)-4-(4-pyrimidin-5-ylphenyl)sulfonylpiperidine-1-carboxamide Traditional Name: N-[2-(methylthio)phenyl]-4-[4-(5-pyrimidyl)phenyl]sulfonyl-piperidine-1-carboxamide Formula: C23H24N4O3S2 MolecularWeight: 468.59166

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1NC(=O)N2CCC(CC2)S(=O)(=O)C3=CC=C(C=C3)C4=CN=CN=C4

Isomeric SMILES

CSC1=CC=CC=C1NC(=O)N2CCC(CC2)S(=O)(=O)C3=CC=C(C=C3)C4=CN=CN=C4

InChI

InChI=1S/C23H24N4O3S2/c1-31-22-5-3-2-4-21(22)26-23(28)27-12-10-20(11-13-27)32(29,30)19-8-6-17(7-9-19)18-14-24-16-25-15-18/h2-9,14-16,20H,10-13H2,1H3,(H,26,28)