1,5-dimethyl-4-propan-2-yl-2-[4-(4-pyridin-2-ylpiperazin-1-yl)sulfonylphenyl]pyrazol-3-one

Systemtic Name: 1,5-dimethyl-4-propan-2-yl-2-[4-(4-pyridin-2-ylpiperazin-1-yl)sulfonylphenyl]pyrazol-3-one Openeye Name: 4-isopropyl-1,5-dimethyl-2-[4-[4-(2-pyridyl)piperazin-1-yl]sulfonylphenyl]pyrazol-3-one CAS Name: 1,5-dimethyl-4-propan-2-yl-2-[4-[[4-(2-pyridinyl)-1-piperazinyl]sulfonyl]phenyl]-3-pyrazolone IUPAC Name: 1,5-dimethyl-4-propan-2-yl-2-[4-(4-pyridin-2-ylpiperazin-1-yl)sulfonylphenyl]pyrazol-3-one Traditional Name: 4-isopropyl-1,5-dimethyl-2-[4-[4-(2-pyridyl)piperazino]sulfonylphenyl]-3-pyrazolin-3-one Formula: C23H29N5O3S MolecularWeight: 455.57306

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=C(C=C2)S(=O)(=O)N3CCN(CC3)C4=CC=CC=N4)C(C)C

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=C(C=C2)S(=O)(=O)N3CCN(CC3)C4=CC=CC=N4)C(C)C

InChI

InChI=1S/C23H29N5O3S/c1-17(2)22-18(3)25(4)28(23(22)29)19-8-10-20(11-9-19)32(30,31)27-15-13-26(14-16-27)21-7-5-6-12-24-21/h5-12,17H,13-16H2,1-4H3