[4-[2-(phenylsulfonyl)ethyl]-1-pyridin-3-ylcarbonyl-piperazin-2-yl]-pyrrolidin-1-yl-methanone

Systemtic Name: [4-[2-(phenylsulfonyl)ethyl]-1-pyridin-3-ylcarbonyl-piperazin-2-yl]-pyrrolidin-1-yl-methanone Openeye Name: [4-[2-(benzenesulfonyl)ethyl]-1-(pyridine-3-carbonyl)piperazin-2-yl]-pyrrolidin-1-yl-methanone CAS Name: [4-[2-(benzenesulfonyl)ethyl]-1-[oxo(3-pyridinyl)methyl]-2-piperazinyl]-(1-pyrrolidinyl)methanone IUPAC Name: [4-[2-(benzenesulfonyl)ethyl]-1-(pyridine-3-carbonyl)piperazin-2-yl]-pyrrolidin-1-ylmethanone Traditional Name: [4-(2-besylethyl)-1-nicotinoyl-piperazin-2-yl]-pyrrolidino-methanone Formula: C23H28N4O4S MolecularWeight: 456.55782

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2CN(CCN2C(=O)C3=CN=CC=C3)CCS(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CCN(C1)C(=O)C2CN(CCN2C(=O)C3=CN=CC=C3)CCS(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C23H28N4O4S/c28-22(19-7-6-10-24-17-19)27-14-13-25(18-21(27)23(29)26-11-4-5-12-26)15-16-32(30,31)20-8-2-1-3-9-20/h1-3,6-10,17,21H,4-5,11-16,18H2