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

Systemtic Name: (3S)-N-(benzimidazol-1-yl)-1-(4-bromophenyl)sulfonyl-piperidine-3-carboxamide Openeye Name: (3S)-N-(benzimidazol-1-yl)-1-(4-bromophenyl)sulfonyl-piperidine-3-carboxamide CAS Name: (3S)-N-(1-benzimidazolyl)-1-(4-bromophenyl)sulfonyl-3-piperidinecarboxamide IUPAC Name: (3S)-N-(benzimidazol-1-yl)-1-(4-bromophenyl)sulfonylpiperidine-3-carboxamide Traditional Name: (3S)-N-(benzimidazol-1-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)NN3C=NC4=CC=CC=C43

Isomeric SMILES

C1C[C@@H](CN(C1)S(=O)(=O)C2=CC=C(C=C2)Br)C(=O)NN3C=NC4=CC=CC=C43

InChI

InChI=1S/C19H19BrN4O3S/c20-15-7-9-16(10-8-15)28(26,27)23-11-3-4-14(12-23)19(25)22-24-13-21-17-5-1-2-6-18(17)24/h1-2,5-10,13-14H,3-4,11-12H2,(H,22,25)/t14-/m0/s1