5-ethoxy-2-[(pyridin-4-ylmethylamino)methylidene]-1-benzothiophen-3-one

Systemtic Name: 5-ethoxy-2-[(pyridin-4-ylmethylamino)methylidene]-1-benzothiophen-3-one Openeye Name: 5-ethoxy-2-[(4-pyridylmethylamino)methylene]benzothiophen-3-one CAS Name: 5-ethoxy-2-[(pyridin-4-ylmethylamino)methylidene]-1-benzothiophen-3-one IUPAC Name: 5-ethoxy-2-[(pyridin-4-ylmethylamino)methylidene]-1-benzothiophen-3-one Traditional Name: 5-ethoxy-2-[(4-pyridylmethylamino)methylene]benzothiophen-3-one Formula: C17H16N2O2S MolecularWeight: 312.38614

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)SC(=CNCC3=CC=NC=C3)C2=O

Isomeric SMILES

CCOC1=CC2=C(C=C1)SC(=CNCC3=CC=NC=C3)C2=O

InChI

InChI=1S/C17H16N2O2S/c1-2-21-13-3-4-15-14(9-13)17(20)16(22-15)11-19-10-12-5-7-18-8-6-12/h3-9,11,19H,2,10H2,1H3