methyl 5-(dimethylcarbamoyl)-2-isothiocyanato-4-methyl-thiophene-3-carboxylate

Systemtic Name: methyl 5-(dimethylcarbamoyl)-2-isothiocyanato-4-methyl-thiophene-3-carboxylate Openeye Name: methyl 5-(dimethylcarbamoyl)-2-isothiocyanato-4-methyl-thiophene-3-carboxylate CAS Name: 5-[dimethylamino(oxo)methyl]-2-isothiocyanato-4-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-(dimethylcarbamoyl)-2-isothiocyanato-4-methylthiophene-3-carboxylate Traditional Name: 5-(dimethylcarbamoyl)-2-isothiocyanato-4-methyl-thiophene-3-carboxylic acid methyl ester Formula: C11H12N2O3S2 MolecularWeight: 284.35458

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H12N2O3S2/c1-6-7(11(15)16-4)9(12-5-17)18-8(6)10(14)13(2)3/h1-4H3