4-piperidin-1-ylsulfonyl-N-(pyridin-3-ylmethyl)-1H-pyrrole-2-carboxamide

Systemtic Name: 4-piperidin-1-ylsulfonyl-N-(pyridin-3-ylmethyl)-1H-pyrrole-2-carboxamide Openeye Name: 4-(1-piperidylsulfonyl)-N-(3-pyridylmethyl)-1H-pyrrole-2-carboxamide CAS Name: 4-(1-piperidinylsulfonyl)-N-(3-pyridinylmethyl)-1H-pyrrole-2-carboxamide IUPAC Name: 4-piperidin-1-ylsulfonyl-N-(pyridin-3-ylmethyl)-1H-pyrrole-2-carboxamide Traditional Name: 4-piperidinosulfonyl-N-(3-pyridylmethyl)-1H-pyrrole-2-carboxamide Formula: C16H20N4O3S MolecularWeight: 348.42

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CNC(=C2)C(=O)NCC3=CN=CC=C3

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CNC(=C2)C(=O)NCC3=CN=CC=C3

InChI

InChI=1S/C16H20N4O3S/c21-16(19-11-13-5-4-6-17-10-13)15-9-14(12-18-15)24(22,23)20-7-2-1-3-8-20/h4-6,9-10,12,18H,1-3,7-8,11H2,(H,19,21)