5-chloranyl-N-[[3-(4-cyanophenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl]thiophene-2-carboxamide

Systemtic Name: 5-chloranyl-N-[[3-(4-cyanophenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl]thiophene-2-carboxamide Openeye Name: 5-chloro-N-[[3-(4-cyanophenyl)-4,5-dihydroisoxazol-5-yl]methyl]thiophene-2-carboxamide CAS Name: 5-chloro-N-[[3-(4-cyanophenyl)-4,5-dihydroisoxazol-5-yl]methyl]-2-thiophenecarboxamide IUPAC Name: 5-chloro-N-[[3-(4-cyanophenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl]thiophene-2-carboxamide Traditional Name: 5-chloro-N-[[3-(4-cyanophenyl)-2-isoxazolin-5-yl]methyl]thiophene-2-carboxamide Formula: C16H12ClN3O2S MolecularWeight: 345.80338

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Descriptors Computed from Structure

Canonical SMILES:

C1C(ON=C1C2=CC=C(C=C2)C#N)CNC(=O)C3=CC=C(S3)Cl

Isomeric SMILES

C1C(ON=C1C2=CC=C(C=C2)C#N)CNC(=O)C3=CC=C(S3)Cl

InChI

InChI=1S/C16H12ClN3O2S/c17-15-6-5-14(23-15)16(21)19-9-12-7-13(20-22-12)11-3-1-10(8-18)2-4-11/h1-6,12H,7,9H2,(H,19,21)