1-(4-bromophenyl)sulfonyl-N-[2-(1,2,4-triazol-1-yl)phenyl]piperidine-3-carboxamide

Systemtic Name: 1-(4-bromophenyl)sulfonyl-N-[2-(1,2,4-triazol-1-yl)phenyl]piperidine-3-carboxamide Openeye Name: 1-(4-bromophenyl)sulfonyl-N-[2-(1,2,4-triazol-1-yl)phenyl]piperidine-3-carboxamide CAS Name: 1-(4-bromophenyl)sulfonyl-N-[2-(1,2,4-triazol-1-yl)phenyl]-3-piperidinecarboxamide IUPAC Name: 1-(4-bromophenyl)sulfonyl-N-[2-(1,2,4-triazol-1-yl)phenyl]piperidine-3-carboxamide Traditional Name: 1-brosyl-N-[2-(1,2,4-triazol-1-yl)phenyl]nipecotamide Formula: C20H20BrN5O3S MolecularWeight: 490.3735

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC=C(C=C2)Br)C(=O)NC3=CC=CC=C3N4C=NC=N4

Isomeric SMILES

C1CC(CN(C1)S(=O)(=O)C2=CC=C(C=C2)Br)C(=O)NC3=CC=CC=C3N4C=NC=N4

InChI

InChI=1S/C20H20BrN5O3S/c21-16-7-9-17(10-8-16)30(28,29)25-11-3-4-15(12-25)20(27)24-18-5-1-2-6-19(18)26-14-22-13-23-26/h1-2,5-10,13-15H,3-4,11-12H2,(H,24,27)