5-(3-iodanylprop-2-ynoxymethylsulfanyl)-3-methoxy-1,2-thiazole-4-carbonitrile

Systemtic Name: 5-(3-iodanylprop-2-ynoxymethylsulfanyl)-3-methoxy-1,2-thiazole-4-carbonitrile Openeye Name: 5-(3-iodoprop-2-ynoxymethylsulfanyl)-3-methoxy-isothiazole-4-carbonitrile CAS Name: 5-(3-iodoprop-2-ynoxymethylthio)-3-methoxy-4-isothiazolecarbonitrile IUPAC Name: 5-(3-iodoprop-2-ynoxymethylsulfanyl)-3-methoxy-1,2-thiazole-4-carbonitrile Traditional Name: 5-(3-iodoprop-2-ynoxymethylthio)-3-methoxy-isothiazole-4-carbonitrile Formula: C9H7IN2O2S2 MolecularWeight: 366.19855

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NSC(=C1C#N)SCOCC#CI

Isomeric SMILES

COC1=NSC(=C1C#N)SCOCC#CI

InChI

InChI=1S/C9H7IN2O2S2/c1-13-8-7(5-11)9(16-12-8)15-6-14-4-2-3-10/h4,6H2,1H3