N-[2-(4-piperidin-1-ylsulfonylphenyl)ethyl]-N'-(pyridin-4-ylmethyl)ethanediamide

Systemtic Name: N-[2-(4-piperidin-1-ylsulfonylphenyl)ethyl]-N'-(pyridin-4-ylmethyl)ethanediamide Openeye Name: N-[2-[4-(1-piperidylsulfonyl)phenyl]ethyl]-N'-(4-pyridylmethyl)oxamide CAS Name: N-[2-[4-(1-piperidinylsulfonyl)phenyl]ethyl]-N'-(pyridin-4-ylmethyl)oxamide IUPAC Name: N-[2-(4-piperidin-1-ylsulfonylphenyl)ethyl]-N'-(pyridin-4-ylmethyl)oxamide Traditional Name: N-[2-(4-piperidinosulfonylphenyl)ethyl]-N'-(4-pyridylmethyl)oxamide Formula: C21H26N4O4S MolecularWeight: 430.52054

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)CCNC(=O)C(=O)NCC3=CC=NC=C3

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)CCNC(=O)C(=O)NCC3=CC=NC=C3

InChI

InChI=1S/C21H26N4O4S/c26-20(21(27)24-16-18-8-11-22-12-9-18)23-13-10-17-4-6-19(7-5-17)30(28,29)25-14-2-1-3-15-25/h4-9,11-12H,1-3,10,13-16H2,(H,23,26)(H,24,27)