5-(4-oxidanylidene-1H-[1,2]thiazolo[4,5-d][1,2,3]triazin-7-yl)-2-prop-2-enoxy-benzenecarbonitrile

Systemtic Name: 5-(4-oxidanylidene-1H-[1,2]thiazolo[4,5-d][1,2,3]triazin-7-yl)-2-prop-2-enoxy-benzenecarbonitrile Openeye Name: 2-allyloxy-5-(4-oxo-1H-isothiazolo[4,5-d]triazin-7-yl)benzonitrile CAS Name: 5-(4-oxo-1H-isothiazolo[4,5-d]triazin-7-yl)-2-prop-2-enoxybenzonitrile IUPAC Name: 5-(4-oxo-1H-[1,2]thiazolo[4,5-d]triazin-7-yl)-2-prop-2-enoxybenzonitrile Traditional Name: 2-allyloxy-5-(4-keto-1H-isothiazolo[4,5-d]triazin-7-yl)benzonitrile Formula: C14H9N5O2S MolecularWeight: 311.31856

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC1=C(C=C(C=C1)C2=NSC3=C2NN=NC3=O)C#N

Isomeric SMILES

C=CCOC1=C(C=C(C=C1)C2=NSC3=C2NN=NC3=O)C#N

InChI

InChI=1S/C14H9N5O2S/c1-2-5-21-10-4-3-8(6-9(10)7-15)11-12-13(22-18-11)14(20)17-19-16-12/h2-4,6H,1,5H2,(H,16,17,20)