1-(2-bromophenyl)-N-(4-pyrrolidin-1-ylsulfonylphenyl)-1,2,3-triazole-4-carboxamide

Systemtic Name: 1-(2-bromophenyl)-N-(4-pyrrolidin-1-ylsulfonylphenyl)-1,2,3-triazole-4-carboxamide Openeye Name: 1-(2-bromophenyl)-N-(4-pyrrolidin-1-ylsulfonylphenyl)triazole-4-carboxamide CAS Name: 1-(2-bromophenyl)-N-[4-(1-pyrrolidinylsulfonyl)phenyl]-4-triazolecarboxamide IUPAC Name: 1-(2-bromophenyl)-N-(4-pyrrolidin-1-ylsulfonylphenyl)triazole-4-carboxamide Traditional Name: 1-(2-bromophenyl)-N-(4-pyrrolidinosulfonylphenyl)triazole-4-carboxamide Formula: C19H18BrN5O3S MolecularWeight: 476.34692

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CN(N=N3)C4=CC=CC=C4Br

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CN(N=N3)C4=CC=CC=C4Br

InChI

InChI=1S/C19H18BrN5O3S/c20-16-5-1-2-6-18(16)25-13-17(22-23-25)19(26)21-14-7-9-15(10-8-14)29(27,28)24-11-3-4-12-24/h1-2,5-10,13H,3-4,11-12H2,(H,21,26)