(3-methyl-2-oxidanyl-phenyl)-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: (3-methyl-2-oxidanyl-phenyl)-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-yl]methanone Openeye Name: (2-hydroxy-3-methyl-phenyl)-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-yl]methanone CAS Name: (2-hydroxy-3-methylphenyl)-[4-(2,4,6-trimethylphenyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: (2-hydroxy-3-methylphenyl)-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-yl]methanone Traditional Name: (2-hydroxy-3-methyl-phenyl)-(4-mesitylsulfonylpiperazino)methanone Formula: C21H26N2O4S MolecularWeight: 402.50714

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1O)C(=O)N2CCN(CC2)S(=O)(=O)C3=C(C=C(C=C3C)C)C

Isomeric SMILES

CC1=CC=CC(=C1O)C(=O)N2CCN(CC2)S(=O)(=O)C3=C(C=C(C=C3C)C)C

InChI

InChI=1S/C21H26N2O4S/c1-14-12-16(3)20(17(4)13-14)28(26,27)23-10-8-22(9-11-23)21(25)18-7-5-6-15(2)19(18)24/h5-7,12-13,24H,8-11H2,1-4H3