2-chloranyl-N-(4-cyano-2-quinolin-2-yl-pyrazol-3-yl)-5-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: 2-chloranyl-N-(4-cyano-2-quinolin-2-yl-pyrazol-3-yl)-5-piperidin-1-ylsulfonyl-benzamide Openeye Name: 2-chloro-N-[4-cyano-2-(2-quinolyl)pyrazol-3-yl]-5-(1-piperidylsulfonyl)benzamide CAS Name: 2-chloro-N-[4-cyano-2-(2-quinolinyl)-3-pyrazolyl]-5-(1-piperidinylsulfonyl)benzamide IUPAC Name: 2-chloro-N-(4-cyano-2-quinolin-2-ylpyrazol-3-yl)-5-piperidin-1-ylsulfonylbenzamide Traditional Name: 2-chloro-N-[4-cyano-2-(2-quinolyl)pyrazol-3-yl]-5-piperidinosulfonyl-benzamide Formula: C25H21ClN6O3S MolecularWeight: 520.99064

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NC3=C(C=NN3C4=NC5=CC=CC=C5C=C4)C#N

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NC3=C(C=NN3C4=NC5=CC=CC=C5C=C4)C#N

InChI

InChI=1S/C25H21ClN6O3S/c26-21-10-9-19(36(34,35)31-12-4-1-5-13-31)14-20(21)25(33)30-24-18(15-27)16-28-32(24)23-11-8-17-6-2-3-7-22(17)29-23/h2-3,6-11,14,16H,1,4-5,12-13H2,(H,30,33)