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

Systemtic Name: 3-[2,6-bis(chloranyl)phenyl]-5-methyl-N-(4-pyrrolidin-1-ylsulfonylphenyl)-1,2-oxazole-4-carboxamide Openeye Name: 3-(2,6-dichlorophenyl)-5-methyl-N-(4-pyrrolidin-1-ylsulfonylphenyl)isoxazole-4-carboxamide CAS Name: 3-(2,6-dichlorophenyl)-5-methyl-N-[4-(1-pyrrolidinylsulfonyl)phenyl]-4-isoxazolecarboxamide IUPAC Name: 3-(2,6-dichlorophenyl)-5-methyl-N-(4-pyrrolidin-1-ylsulfonylphenyl)-1,2-oxazole-4-carboxamide Traditional Name: 3-(2,6-dichlorophenyl)-5-methyl-N-(4-pyrrolidinosulfonylphenyl)isoxazole-4-carboxamide Formula: C21H19Cl2N3O4S MolecularWeight: 480.36426

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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)S(=O)(=O)N4CCCC4

Isomeric SMILES

CC1=C(C(=NO1)C2=C(C=CC=C2Cl)Cl)C(=O)NC3=CC=C(C=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C21H19Cl2N3O4S/c1-13-18(20(25-30-13)19-16(22)5-4-6-17(19)23)21(27)24-14-7-9-15(10-8-14)31(28,29)26-11-2-3-12-26/h4-10H,2-3,11-12H2,1H3,(H,24,27)