[4-[2,5-bis(chloranyl)-3,6-dimethyl-phenyl]sulfonylpiperazin-1-yl]-pyridin-2-yl-methanone

Systemtic Name: [4-[2,5-bis(chloranyl)-3,6-dimethyl-phenyl]sulfonylpiperazin-1-yl]-pyridin-2-yl-methanone Openeye Name: [4-(2,5-dichloro-3,6-dimethyl-phenyl)sulfonylpiperazin-1-yl]-(2-pyridyl)methanone CAS Name: [4-(2,5-dichloro-3,6-dimethylphenyl)sulfonyl-1-piperazinyl]-(2-pyridinyl)methanone IUPAC Name: [4-(2,5-dichloro-3,6-dimethylphenyl)sulfonylpiperazin-1-yl]-pyridin-2-ylmethanone Traditional Name: [4-(2,5-dichloro-3,6-dimethyl-phenyl)sulfonylpiperazino]-(2-pyridyl)methanone Formula: C18H19Cl2N3O3S MolecularWeight: 428.33276

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1Cl)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=CC=N3)C)Cl

Isomeric SMILES

CC1=CC(=C(C(=C1Cl)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=CC=N3)C)Cl

InChI

InChI=1S/C18H19Cl2N3O3S/c1-12-11-14(19)13(2)17(16(12)20)27(25,26)23-9-7-22(8-10-23)18(24)15-5-3-4-6-21-15/h3-6,11H,7-10H2,1-2H3