[4-(phenylmethyl)piperidin-1-yl]-(4-piperidin-1-ylsulfonyl-1H-pyrrol-2-yl)methanone

Systemtic Name: [4-(phenylmethyl)piperidin-1-yl]-(4-piperidin-1-ylsulfonyl-1H-pyrrol-2-yl)methanone Openeye Name: (4-benzyl-1-piperidyl)-[4-(1-piperidylsulfonyl)-1H-pyrrol-2-yl]methanone CAS Name: [4-(phenylmethyl)-1-piperidinyl]-[4-(1-piperidinylsulfonyl)-1H-pyrrol-2-yl]methanone IUPAC Name: (4-benzylpiperidin-1-yl)-(4-piperidin-1-ylsulfonyl-1H-pyrrol-2-yl)methanone Traditional Name: (4-benzylpiperidino)-(4-piperidinosulfonyl-1H-pyrrol-2-yl)methanone Formula: C22H29N3O3S MolecularWeight: 415.54896

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CNC(=C2)C(=O)N3CCC(CC3)CC4=CC=CC=C4

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CNC(=C2)C(=O)N3CCC(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C22H29N3O3S/c26-22(24-13-9-19(10-14-24)15-18-7-3-1-4-8-18)21-16-20(17-23-21)29(27,28)25-11-5-2-6-12-25/h1,3-4,7-8,16-17,19,23H,2,5-6,9-15H2