N-[1-(phenylmethyl)piperidin-4-yl]-4-piperidin-1-ylsulfonyl-1H-pyrrole-2-carboxamide

Systemtic Name: N-[1-(phenylmethyl)piperidin-4-yl]-4-piperidin-1-ylsulfonyl-1H-pyrrole-2-carboxamide Openeye Name: N-(1-benzyl-4-piperidyl)-4-(1-piperidylsulfonyl)-1H-pyrrole-2-carboxamide CAS Name: N-[1-(phenylmethyl)-4-piperidinyl]-4-(1-piperidinylsulfonyl)-1H-pyrrole-2-carboxamide IUPAC Name: N-(1-benzylpiperidin-4-yl)-4-piperidin-1-ylsulfonyl-1H-pyrrole-2-carboxamide Traditional Name: N-(1-benzyl-4-piperidyl)-4-piperidinosulfonyl-1H-pyrrole-2-carboxamide Formula: C22H30N4O3S MolecularWeight: 430.5636

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CNC(=C2)C(=O)NC3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CNC(=C2)C(=O)NC3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C22H30N4O3S/c27-22(21-15-20(16-23-21)30(28,29)26-11-5-2-6-12-26)24-19-9-13-25(14-10-19)17-18-7-3-1-4-8-18/h1,3-4,7-8,15-16,19,23H,2,5-6,9-14,17H2,(H,24,27)