CHEBI:116958 - N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-methyl-4-nitro-3-isoxazolecarboxamide

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ChEBI Name N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-methyl-4-nitro-3-isoxazolecarboxamide ChEBI ID CHEBI:116958 Stars This entity has been manually annotated by a third party. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C14H12N4O4S Net Charge 0 Average Mass 332.336 Monoisotopic Mass 332.05793 InChI InChI=1S/C14H12N4O4S/c1-7-12(18(20)21)11(17-22-7)13(19)16-14-9(6-15)8-4-2-3-5-10(8)23-14/h2-5H2,1H3,(H,16,19) InChIKey MRLCOQNXYQPSLO-UHFFFAOYSA-N SMILES CC1=C(C(=NO1)C(=O)NC2=C(C3=C(S2)CCCC3)C#N)[N+](=O)[O-] ChEBI Ontology Outgoing N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-methyl-4-nitro-3-isoxazolecarboxamide (CHEBI:116958) is a aromatic amide (CHEBI:62733) N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-methyl-4-nitro-3-isoxazolecarboxamide (CHEBI:116958) is a heteroarene (CHEBI:33833) Manual Xref Database LSM-28407 LINCS View more database links