(4-chloranylpyridin-2-yl)-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: (4-chloranylpyridin-2-yl)-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-yl]methanone Openeye Name: (4-chloro-2-pyridyl)-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-yl]methanone CAS Name: (4-chloro-2-pyridinyl)-[4-(2,4,6-trimethylphenyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: (4-chloropyridin-2-yl)-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-yl]methanone Traditional Name: (4-chloro-2-pyridyl)-(4-mesitylsulfonylpiperazino)methanone Formula: C19H22ClN3O3S MolecularWeight: 407.91428

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H22ClN3O3S/c1-13-10-14(2)18(15(3)11-13)27(25,26)23-8-6-22(7-9-23)19(24)17-12-16(20)4-5-21-17/h4-5,10-12H,6-9H2,1-3H3