2-chloranyl-N-[[4-(4-methanethioylphenyl)-5-oxidanylidene-1,2-oxazol-2-yl]methyl]ethanamide

Systemtic Name: 2-chloranyl-N-[[4-(4-methanethioylphenyl)-5-oxidanylidene-1,2-oxazol-2-yl]methyl]ethanamide Openeye Name: 2-chloro-N-[[4-(4-methanethioylphenyl)-5-oxo-isoxazol-2-yl]methyl]acetamide CAS Name: 2-chloro-N-[[4-(4-methanethioylphenyl)-5-oxo-2-isoxazolyl]methyl]acetamide IUPAC Name: 2-chloro-N-[[4-(4-methanethioylphenyl)-5-oxo-1,2-oxazol-2-yl]methyl]acetamide Traditional Name: 2-chloro-N-[[5-keto-4-(4-thioformylphenyl)-3-isoxazolin-2-yl]methyl]acetamide Formula: C13H11ClN2O3S MolecularWeight: 310.75604

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=S)C2=CN(OC2=O)CNC(=O)CCl

Isomeric SMILES

C1=CC(=CC=C1C=S)C2=CN(OC2=O)CNC(=O)CCl

InChI

InChI=1S/C13H11ClN2O3S/c14-5-12(17)15-8-16-6-11(13(18)19-16)10-3-1-9(7-20)2-4-10/h1-4,6-7H,5,8H2,(H,15,17)