3-[(4-chlorophenyl)sulfanylmethyl]-N4-(2-methoxyethyl)-N5-propyl-1,2-oxazole-4,5-dicarboxamide

Systemtic Name: 3-[(4-chlorophenyl)sulfanylmethyl]-N4-(2-methoxyethyl)-N5-propyl-1,2-oxazole-4,5-dicarboxamide Openeye Name: 3-[(4-chlorophenyl)sulfanylmethyl]-N4-(2-methoxyethyl)-N5-propyl-isoxazole-4,5-dicarboxamide CAS Name: 3-[[(4-chlorophenyl)thio]methyl]-N4-(2-methoxyethyl)-N5-propylisoxazole-4,5-dicarboxamide IUPAC Name: 3-[(4-chlorophenyl)sulfanylmethyl]-4-N-(2-methoxyethyl)-5-N-propyl-1,2-oxazole-4,5-dicarboxamide Traditional Name: 3-[[(4-chlorophenyl)thio]methyl]-N-(2-methoxyethyl)-N'-propyl-isoxazole-4,5-dicarboxamide Formula: C18H22ClN3O4S MolecularWeight: 411.90298

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1=C(C(=NO1)CSC2=CC=C(C=C2)Cl)C(=O)NCCOC

Isomeric SMILES

CCCNC(=O)C1=C(C(=NO1)CSC2=CC=C(C=C2)Cl)C(=O)NCCOC

InChI

InChI=1S/C18H22ClN3O4S/c1-3-8-20-18(24)16-15(17(23)21-9-10-25-2)14(22-26-16)11-27-13-6-4-12(19)5-7-13/h4-7H,3,8-11H2,1-2H3,(H,20,24)(H,21,23)