N-[(2-chloranyl-5-pyrrolidin-1-ylsulfonyl-phenyl)carbamothioyl]-3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carboxamide

Systemtic Name: N-[(2-chloranyl-5-pyrrolidin-1-ylsulfonyl-phenyl)carbamothioyl]-3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carboxamide Openeye Name: 3-(2-chlorophenyl)-N-[(2-chloro-5-pyrrolidin-1-ylsulfonyl-phenyl)carbamothioyl]-5-methyl-isoxazole-4-carboxamide CAS Name: 3-(2-chlorophenyl)-N-[[2-chloro-5-(1-pyrrolidinylsulfonyl)anilino]-sulfanylidenemethyl]-5-methyl-4-isoxazolecarboxamide IUPAC Name: 3-(2-chlorophenyl)-N-[(2-chloro-5-pyrrolidin-1-ylsulfonylphenyl)carbamothioyl]-5-methyl-1,2-oxazole-4-carboxamide Traditional Name: 3-(2-chlorophenyl)-N-[(2-chloro-5-pyrrolidinosulfonyl-phenyl)thiocarbamoyl]-5-methyl-isoxazole-4-carboxamide Formula: C22H20Cl2N4O4S2 MolecularWeight: 539.4546

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H20Cl2N4O4S2/c1-13-19(20(27-32-13)15-6-2-3-7-16(15)23)21(29)26-22(33)25-18-12-14(8-9-17(18)24)34(30,31)28-10-4-5-11-28/h2-3,6-9,12H,4-5,10-11H2,1H3,(H2,25,26,29,33)