2-oxidanylidene-N-[2-[4-(phenylmethyl)piperidin-1-yl]ethyl]-6-pyrrolidin-1-ylsulfonyl-1H-quinoline-4-carboxamide

Systemtic Name: 2-oxidanylidene-N-[2-[4-(phenylmethyl)piperidin-1-yl]ethyl]-6-pyrrolidin-1-ylsulfonyl-1H-quinoline-4-carboxamide Openeye Name: N-[2-(4-benzyl-1-piperidyl)ethyl]-2-oxo-6-pyrrolidin-1-ylsulfonyl-1H-quinoline-4-carboxamide CAS Name: 2-oxo-N-[2-[4-(phenylmethyl)-1-piperidinyl]ethyl]-6-(1-pyrrolidinylsulfonyl)-1H-quinoline-4-carboxamide IUPAC Name: N-[2-(4-benzylpiperidin-1-yl)ethyl]-2-oxo-6-pyrrolidin-1-ylsulfonyl-1H-quinoline-4-carboxamide Traditional Name: N-[2-(4-benzylpiperidino)ethyl]-2-keto-6-pyrrolidinosulfonyl-1H-quinoline-4-carboxamide Formula: C28H34N4O4S MolecularWeight: 522.65896

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC3=C(C=C2)NC(=O)C=C3C(=O)NCCN4CCC(CC4)CC5=CC=CC=C5

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC3=C(C=C2)NC(=O)C=C3C(=O)NCCN4CCC(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C28H34N4O4S/c33-27-20-25(24-19-23(8-9-26(24)30-27)37(35,36)32-13-4-5-14-32)28(34)29-12-17-31-15-10-22(11-16-31)18-21-6-2-1-3-7-21/h1-3,6-9,19-20,22H,4-5,10-18H2,(H,29,34)(H,30,33)