3-(methoxymethyl)-4-[(thiophen-2-ylmethylamino)methylidene]-1H-pyrazol-5-one

Systemtic Name: 3-(methoxymethyl)-4-[(thiophen-2-ylmethylamino)methylidene]-1H-pyrazol-5-one Openeye Name: 3-(methoxymethyl)-4-[(2-thienylmethylamino)methylene]-1H-pyrazol-5-one CAS Name: 3-(methoxymethyl)-4-[(thiophen-2-ylmethylamino)methylidene]-1H-pyrazol-5-one IUPAC Name: 3-(methoxymethyl)-4-[(thiophen-2-ylmethylamino)methylidene]-1H-pyrazol-5-one Traditional Name: 5-(methoxymethyl)-4-[(2-thenylamino)methylene]-2-pyrazolin-3-one Formula: C11H13N3O2S MolecularWeight: 251.30482

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Descriptors Computed from Structure

Canonical SMILES:

COCC1=NNC(=O)C1=CNCC2=CC=CS2

Isomeric SMILES

COCC1=NNC(=O)C1=CNCC2=CC=CS2

InChI

InChI=1S/C11H13N3O2S/c1-16-7-10-9(11(15)14-13-10)6-12-5-8-3-2-4-17-8/h2-4,6,12H,5,7H2,1H3,(H,14,15)