4-[1-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonyl]piperidin-4-yl]carbonyl-1-phenethyl-piperazine-2,6-dione

Systemtic Name: 4-[1-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonyl]piperidin-4-yl]carbonyl-1-phenethyl-piperazine-2,6-dione Openeye Name: 4-[1-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonyl]piperidine-4-carbonyl]-1-phenethyl-piperazine-2,6-dione CAS Name: 4-[[1-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonyl]-4-piperidinyl]-oxomethyl]-1-phenethylpiperazine-2,6-dione IUPAC Name: 4-[1-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonyl]piperidine-4-carbonyl]-1-phenethylpiperazine-2,6-dione Traditional Name: 4-[1-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonyl]isonipecotoyl]-1-phenethyl-piperazine-2,6-quinone Formula: C23H29N5O5S MolecularWeight: 487.57186

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1)C)S(=O)(=O)N2CCC(CC2)C(=O)N3CC(=O)N(C(=O)C3)CCC4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=NN1)C)S(=O)(=O)N2CCC(CC2)C(=O)N3CC(=O)N(C(=O)C3)CCC4=CC=CC=C4

InChI

InChI=1S/C23H29N5O5S/c1-16-22(17(2)25-24-16)34(32,33)27-11-9-19(10-12-27)23(31)26-14-20(29)28(21(30)15-26)13-8-18-6-4-3-5-7-18/h3-7,19H,8-15H2,1-2H3,(H,24,25)