3-(2-chlorophenyl)-5-methyl-N-(oxolan-2-ylmethylcarbamothioyl)-1,2-oxazole-4-carboxamide

Systemtic Name: 3-(2-chlorophenyl)-5-methyl-N-(oxolan-2-ylmethylcarbamothioyl)-1,2-oxazole-4-carboxamide Openeye Name: 3-(2-chlorophenyl)-5-methyl-N-(tetrahydrofuran-2-ylmethylcarbamothioyl)isoxazole-4-carboxamide CAS Name: 3-(2-chlorophenyl)-5-methyl-N-[(2-oxolanylmethylamino)-sulfanylidenemethyl]-4-isoxazolecarboxamide IUPAC Name: 3-(2-chlorophenyl)-5-methyl-N-(oxolan-2-ylmethylcarbamothioyl)-1,2-oxazole-4-carboxamide Traditional Name: 3-(2-chlorophenyl)-5-methyl-N-(tetrahydrofurfurylthiocarbamoyl)isoxazole-4-carboxamide Formula: C17H18ClN3O3S MolecularWeight: 379.86112

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C2=CC=CC=C2Cl)C(=O)NC(=S)NCC3CCCO3

Isomeric SMILES

CC1=C(C(=NO1)C2=CC=CC=C2Cl)C(=O)NC(=S)NCC3CCCO3

InChI

InChI=1S/C17H18ClN3O3S/c1-10-14(15(21-24-10)12-6-2-3-7-13(12)18)16(22)20-17(25)19-9-11-5-4-8-23-11/h2-3,6-7,11H,4-5,8-9H2,1H3,(H2,19,20,22,25)