N-[3-chloranyl-4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]-1-propylsulfonyl-piperidine-2-carboxamide

Systemtic Name: N-[3-chloranyl-4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]-1-propylsulfonyl-piperidine-2-carboxamide Openeye Name: N-[3-chloro-4-(2-oxopyrrolidin-1-yl)phenyl]-1-propylsulfonyl-piperidine-2-carboxamide CAS Name: N-[3-chloro-4-(2-oxo-1-pyrrolidinyl)phenyl]-1-propylsulfonyl-2-piperidinecarboxamide IUPAC Name: N-[3-chloro-4-(2-oxopyrrolidin-1-yl)phenyl]-1-propylsulfonylpiperidine-2-carboxamide Traditional Name: N-[3-chloro-4-(2-ketopyrrolidino)phenyl]-1-propylsulfonyl-pipecolinamide Formula: C19H26ClN3O4S MolecularWeight: 427.94544

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)N1CCCCC1C(=O)NC2=CC(=C(C=C2)N3CCCC3=O)Cl

Isomeric SMILES

CCCS(=O)(=O)N1CCCCC1C(=O)NC2=CC(=C(C=C2)N3CCCC3=O)Cl

InChI

InChI=1S/C19H26ClN3O4S/c1-2-12-28(26,27)23-11-4-3-6-17(23)19(25)21-14-8-9-16(15(20)13-14)22-10-5-7-18(22)24/h8-9,13,17H,2-7,10-12H2,1H3,(H,21,25)