(2E)-5-(benzimidazol-1-yl)-4-chloranyl-2-[methoxy(oxidanyl)methylidene]thiophen-3-one

Systemtic Name: (2E)-5-(benzimidazol-1-yl)-4-chloranyl-2-[methoxy(oxidanyl)methylidene]thiophen-3-one Openeye Name: (2E)-5-(benzimidazol-1-yl)-4-chloro-2-[hydroxy(methoxy)methylene]thiophen-3-one CAS Name: (2E)-5-(1-benzimidazolyl)-4-chloro-2-[hydroxy(methoxy)methylidene]-3-thiophenone IUPAC Name: (2E)-5-(benzimidazol-1-yl)-4-chloro-2-[hydroxy(methoxy)methylidene]thiophen-3-one Traditional Name: (2E)-5-(benzimidazol-1-yl)-4-chloro-2-[hydroxy(methoxy)methylene]thiophen-3-one Formula: C13H9ClN2O3S MolecularWeight: 308.74016

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Descriptors Computed from Structure

Canonical SMILES:

COC(=C1C(=O)C(=C(S1)N2C=NC3=CC=CC=C32)Cl)O

Isomeric SMILES

CO/C(=C/1\C(=O)C(=C(S1)N2C=NC3=CC=CC=C32)Cl)/O

InChI

InChI=1S/C13H9ClN2O3S/c1-19-13(18)11-10(17)9(14)12(20-11)16-6-15-7-4-2-3-5-8(7)16/h2-6,18H,1H3/b13-11+