2-methyl-2-phenyl-1-[4-(1-pyridin-3-ylsulfonylpiperidin-4-yl)carbonylpiperazin-1-yl]propan-1-one

Systemtic Name: 2-methyl-2-phenyl-1-[4-(1-pyridin-3-ylsulfonylpiperidin-4-yl)carbonylpiperazin-1-yl]propan-1-one Openeye Name: 2-methyl-2-phenyl-1-[4-[1-(3-pyridylsulfonyl)piperidine-4-carbonyl]piperazin-1-yl]propan-1-one CAS Name: 2-methyl-1-[4-[oxo-[1-(3-pyridinylsulfonyl)-4-piperidinyl]methyl]-1-piperazinyl]-2-phenyl-1-propanone IUPAC Name: 2-methyl-2-phenyl-1-[4-(1-pyridin-3-ylsulfonylpiperidine-4-carbonyl)piperazin-1-yl]propan-1-one Traditional Name: 2-methyl-2-phenyl-1-[4-[1-(3-pyridylsulfonyl)isonipecotoyl]piperazino]propan-1-one Formula: C25H32N4O4S MolecularWeight: 484.61098

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC=CC=C1)C(=O)N2CCN(CC2)C(=O)C3CCN(CC3)S(=O)(=O)C4=CN=CC=C4

Isomeric SMILES

CC(C)(C1=CC=CC=C1)C(=O)N2CCN(CC2)C(=O)C3CCN(CC3)S(=O)(=O)C4=CN=CC=C4

InChI

InChI=1S/C25H32N4O4S/c1-25(2,21-7-4-3-5-8-21)24(31)28-17-15-27(16-18-28)23(30)20-10-13-29(14-11-20)34(32,33)22-9-6-12-26-19-22/h3-9,12,19-20H,10-11,13-18H2,1-2H3