N-[5-chloranyl-2-(1,2,4-triazol-1-yl)phenyl]-1-(phenylsulfonyl)piperidine-4-carboxamide

Systemtic Name: N-[5-chloranyl-2-(1,2,4-triazol-1-yl)phenyl]-1-(phenylsulfonyl)piperidine-4-carboxamide Openeye Name: 1-(benzenesulfonyl)-N-[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]piperidine-4-carboxamide CAS Name: 1-(benzenesulfonyl)-N-[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]-4-piperidinecarboxamide IUPAC Name: 1-(benzenesulfonyl)-N-[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]piperidine-4-carboxamide Traditional Name: 1-besyl-N-[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]isonipecotamide Formula: C20H20ClN5O3S MolecularWeight: 445.9225

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=C(C=CC(=C2)Cl)N3C=NC=N3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1C(=O)NC2=C(C=CC(=C2)Cl)N3C=NC=N3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C20H20ClN5O3S/c21-16-6-7-19(26-14-22-13-23-26)18(12-16)24-20(27)15-8-10-25(11-9-15)30(28,29)17-4-2-1-3-5-17/h1-7,12-15H,8-11H2,(H,24,27)