5-bromanyl-N-(4-methoxy-3-piperidin-1-ylsulfonyl-phenyl)pyridine-3-carboxamide

Systemtic Name: 5-bromanyl-N-(4-methoxy-3-piperidin-1-ylsulfonyl-phenyl)pyridine-3-carboxamide Openeye Name: 5-bromo-N-[4-methoxy-3-(1-piperidylsulfonyl)phenyl]pyridine-3-carboxamide CAS Name: 5-bromo-N-[4-methoxy-3-(1-piperidinylsulfonyl)phenyl]-3-pyridinecarboxamide IUPAC Name: 5-bromo-N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)pyridine-3-carboxamide Traditional Name: 5-bromo-N-(4-methoxy-3-piperidinosulfonyl-phenyl)nicotinamide Formula: C18H20BrN3O4S MolecularWeight: 454.3381

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)C2=CC(=CN=C2)Br)S(=O)(=O)N3CCCCC3

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)C2=CC(=CN=C2)Br)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C18H20BrN3O4S/c1-26-16-6-5-15(21-18(23)13-9-14(19)12-20-11-13)10-17(16)27(24,25)22-7-3-2-4-8-22/h5-6,9-12H,2-4,7-8H2,1H3,(H,21,23)