(1-tert-butyl-5-methyl-pyrazol-4-yl)-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: (1-tert-butyl-5-methyl-pyrazol-4-yl)-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]methanone Openeye Name: (1-tert-butyl-5-methyl-pyrazol-4-yl)-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]methanone CAS Name: (1-tert-butyl-5-methyl-4-pyrazolyl)-[4-(2,4-dimethylphenyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: (1-tert-butyl-5-methylpyrazol-4-yl)-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]methanone Traditional Name: (1-tert-butyl-5-methyl-pyrazol-4-yl)-[4-(2,4-dimethylphenyl)sulfonylpiperazino]methanone Formula: C21H30N4O3S MolecularWeight: 418.5529

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=C(N(N=C3)C(C)(C)C)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=C(N(N=C3)C(C)(C)C)C)C

InChI

InChI=1S/C21H30N4O3S/c1-15-7-8-19(16(2)13-15)29(27,28)24-11-9-23(10-12-24)20(26)18-14-22-25(17(18)3)21(4,5)6/h7-8,13-14H,9-12H2,1-6H3