N-[2-[(2-bromophenyl)amino]-2-oxidanylidene-ethyl]-1-pyridin-3-ylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[2-[(2-bromophenyl)amino]-2-oxidanylidene-ethyl]-1-pyridin-3-ylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[2-(2-bromoanilino)-2-oxo-ethyl]-1-(3-pyridylsulfonyl)piperidine-4-carboxamide CAS Name: N-[2-(2-bromoanilino)-2-oxoethyl]-1-(3-pyridinylsulfonyl)-4-piperidinecarboxamide IUPAC Name: N-[2-(2-bromoanilino)-2-oxoethyl]-1-pyridin-3-ylsulfonylpiperidine-4-carboxamide Traditional Name: N-[2-(2-bromoanilino)-2-keto-ethyl]-1-(3-pyridylsulfonyl)isonipecotamide Formula: C19H21BrN4O4S MolecularWeight: 481.36344

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCC(=O)NC2=CC=CC=C2Br)S(=O)(=O)C3=CN=CC=C3

Isomeric SMILES

C1CN(CCC1C(=O)NCC(=O)NC2=CC=CC=C2Br)S(=O)(=O)C3=CN=CC=C3

InChI

InChI=1S/C19H21BrN4O4S/c20-16-5-1-2-6-17(16)23-18(25)13-22-19(26)14-7-10-24(11-8-14)29(27,28)15-4-3-9-21-12-15/h1-6,9,12,14H,7-8,10-11,13H2,(H,22,26)(H,23,25)