N-(1H-benzimidazol-2-yl)-1-(4-bromophenyl)sulfonyl-piperidine-3-carboxamide

Systemtic Name: N-(1H-benzimidazol-2-yl)-1-(4-bromophenyl)sulfonyl-piperidine-3-carboxamide Openeye Name: N-(1H-benzimidazol-2-yl)-1-(4-bromophenyl)sulfonyl-piperidine-3-carboxamide CAS Name: N-(1H-benzimidazol-2-yl)-1-(4-bromophenyl)sulfonyl-3-piperidinecarboxamide IUPAC Name: N-(1H-benzimidazol-2-yl)-1-(4-bromophenyl)sulfonylpiperidine-3-carboxamide Traditional Name: N-(1H-benzimidazol-2-yl)-1-brosyl-nipecotamide Formula: C19H19BrN4O3S MolecularWeight: 463.34816

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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=NC4=CC=CC=C4N3

Isomeric SMILES

C1CC(CN(C1)S(=O)(=O)C2=CC=C(C=C2)Br)C(=O)NC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C19H19BrN4O3S/c20-14-7-9-15(10-8-14)28(26,27)24-11-3-4-13(12-24)18(25)23-19-21-16-5-1-2-6-17(16)22-19/h1-2,5-10,13H,3-4,11-12H2,(H2,21,22,23,25)