methyl 2-isothiocyanato-4,5-dimethyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-isothiocyanato-4,5-dimethyl-thiophene-3-carboxylate Openeye Name: methyl 2-isothiocyanato-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 2-isothiocyanato-4,5-dimethyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-isothiocyanato-4,5-dimethylthiophene-3-carboxylate Traditional Name: 2-isothiocyanato-4,5-dimethyl-thiophene-3-carboxylic acid methyl ester Formula: C9H9NO2S2 MolecularWeight: 227.30326

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)N=C=S)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)N=C=S)C

InChI

InChI=1S/C9H9NO2S2/c1-5-6(2)14-8(10-4-13)7(5)9(11)12-3/h1-3H3