3-[2,6-bis(chloranyl)phenyl]-5-methyl-N-(4-pyridin-2-ylsulfanylphenyl)-1,2-oxazole-4-carboxamide

Systemtic Name: 3-[2,6-bis(chloranyl)phenyl]-5-methyl-N-(4-pyridin-2-ylsulfanylphenyl)-1,2-oxazole-4-carboxamide Openeye Name: 3-(2,6-dichlorophenyl)-5-methyl-N-[4-(2-pyridylsulfanyl)phenyl]isoxazole-4-carboxamide CAS Name: 3-(2,6-dichlorophenyl)-5-methyl-N-[4-(2-pyridinylthio)phenyl]-4-isoxazolecarboxamide IUPAC Name: 3-(2,6-dichlorophenyl)-5-methyl-N-(4-pyridin-2-ylsulfanylphenyl)-1,2-oxazole-4-carboxamide Traditional Name: 3-(2,6-dichlorophenyl)-5-methyl-N-[4-(2-pyridylthio)phenyl]isoxazole-4-carboxamide Formula: C22H15Cl2N3O2S MolecularWeight: 456.3444

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C2=C(C=CC=C2Cl)Cl)C(=O)NC3=CC=C(C=C3)SC4=CC=CC=N4

Isomeric SMILES

CC1=C(C(=NO1)C2=C(C=CC=C2Cl)Cl)C(=O)NC3=CC=C(C=C3)SC4=CC=CC=N4

InChI

InChI=1S/C22H15Cl2N3O2S/c1-13-19(21(27-29-13)20-16(23)5-4-6-17(20)24)22(28)26-14-8-10-15(11-9-14)30-18-7-2-3-12-25-18/h2-12H,1H3,(H,26,28)