3-bromanyl-N-(3-pyrrolidin-1-ylsulfonylphenyl)-6-(1,2,4-triazol-4-yl)pyridine-2-carboxamide

Systemtic Name: 3-bromanyl-N-(3-pyrrolidin-1-ylsulfonylphenyl)-6-(1,2,4-triazol-4-yl)pyridine-2-carboxamide Openeye Name: 3-bromo-N-(3-pyrrolidin-1-ylsulfonylphenyl)-6-(1,2,4-triazol-4-yl)pyridine-2-carboxamide CAS Name: 3-bromo-N-[3-(1-pyrrolidinylsulfonyl)phenyl]-6-(1,2,4-triazol-4-yl)-2-pyridinecarboxamide IUPAC Name: 3-bromo-N-(3-pyrrolidin-1-ylsulfonylphenyl)-6-(1,2,4-triazol-4-yl)pyridine-2-carboxamide Traditional Name: 3-bromo-N-(3-pyrrolidinosulfonylphenyl)-6-(1,2,4-triazol-4-yl)picolinamide Formula: C18H17BrN6O3S MolecularWeight: 477.33498

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)C3=C(C=CC(=N3)N4C=NN=C4)Br

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)C3=C(C=CC(=N3)N4C=NN=C4)Br

InChI

InChI=1S/C18H17BrN6O3S/c19-15-6-7-16(24-11-20-21-12-24)23-17(15)18(26)22-13-4-3-5-14(10-13)29(27,28)25-8-1-2-9-25/h3-7,10-12H,1-2,8-9H2,(H,22,26)