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

Systemtic Name: 3-methoxy-5-(prop-2-ynoxymethylsulfanyl)-1,2-thiazole-4-carbonitrile Openeye Name: 3-methoxy-5-(prop-2-ynoxymethylsulfanyl)isothiazole-4-carbonitrile CAS Name: 3-methoxy-5-(prop-2-ynoxymethylthio)-4-isothiazolecarbonitrile IUPAC Name: 3-methoxy-5-(prop-2-ynoxymethylsulfanyl)-1,2-thiazole-4-carbonitrile Traditional Name: 3-methoxy-5-(propargyloxymethylthio)isothiazole-4-carbonitrile Formula: C9H8N2O2S2 MolecularWeight: 240.30202

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H8N2O2S2/c1-3-4-13-6-14-9-7(5-10)8(12-2)11-15-9/h1H,4,6H2,2H3