2-chloranyl-N-[2-(diethylamino)-5-piperidin-1-ylsulfonyl-phenyl]pyridine-4-carboxamide

Systemtic Name: 2-chloranyl-N-[2-(diethylamino)-5-piperidin-1-ylsulfonyl-phenyl]pyridine-4-carboxamide Openeye Name: 2-chloro-N-[2-(diethylamino)-5-(1-piperidylsulfonyl)phenyl]pyridine-4-carboxamide CAS Name: 2-chloro-N-[2-(diethylamino)-5-(1-piperidinylsulfonyl)phenyl]-4-pyridinecarboxamide IUPAC Name: 2-chloro-N-[2-(diethylamino)-5-piperidin-1-ylsulfonylphenyl]pyridine-4-carboxamide Traditional Name: 2-chloro-N-[2-(diethylamino)-5-piperidinosulfonyl-phenyl]isonicotinamide Formula: C21H27ClN4O3S MolecularWeight: 450.98208

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C3=CC(=NC=C3)Cl

Isomeric SMILES

CCN(CC)C1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C3=CC(=NC=C3)Cl

InChI

InChI=1S/C21H27ClN4O3S/c1-3-25(4-2)19-9-8-17(30(28,29)26-12-6-5-7-13-26)15-18(19)24-21(27)16-10-11-23-20(22)14-16/h8-11,14-15H,3-7,12-13H2,1-2H3,(H,24,27)