3-[1-[2,6-bis(chloranyl)-3-fluoranyl-phenyl]ethoxy]-5-[1-[1,1-bis(oxidanylidene)thian-4-yl]pyrazol-4-yl]pyridin-2-amine

Systemtic Name: 3-[1-[2,6-bis(chloranyl)-3-fluoranyl-phenyl]ethoxy]-5-[1-[1,1-bis(oxidanylidene)thian-4-yl]pyrazol-4-yl]pyridin-2-amine Openeye Name: 3-[1-(2,6-dichloro-3-fluoro-phenyl)ethoxy]-5-[1-(1,1-dioxothian-4-yl)pyrazol-4-yl]pyridin-2-amine CAS Name: 3-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-5-[1-(1,1-dioxo-4-thianyl)-4-pyrazolyl]-2-pyridinamine IUPAC Name: 3-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-5-[1-(1,1-dioxothian-4-yl)pyrazol-4-yl]pyridin-2-amine Traditional Name: [3-[1-(2,6-dichloro-3-fluoro-phenyl)ethoxy]-5-[1-(1,1-diketothian-4-yl)pyrazol-4-yl]-2-pyridyl]amine Formula: C21H21Cl2FN4O3S MolecularWeight: 499.385843

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C=CC(=C1Cl)F)Cl)OC2=C(N=CC(=C2)C3=CN(N=C3)C4CCS(=O)(=O)CC4)N

Isomeric SMILES

CC(C1=C(C=CC(=C1Cl)F)Cl)OC2=C(N=CC(=C2)C3=CN(N=C3)C4CCS(=O)(=O)CC4)N

InChI

InChI=1S/C21H21Cl2FN4O3S/c1-12(19-16(22)2-3-17(24)20(19)23)31-18-8-13(9-26-21(18)25)14-10-27-28(11-14)15-4-6-32(29,30)7-5-15/h2-3,8-12,15H,4-7H2,1H3,(H2,25,26)