methyl 4,5-diethyl-2-isocyanato-thiophene-3-carboxylate

Systemtic Name: methyl 4,5-diethyl-2-isocyanato-thiophene-3-carboxylate Openeye Name: methyl 4,5-diethyl-2-isocyanato-thiophene-3-carboxylate CAS Name: 4,5-diethyl-2-isocyanato-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4,5-diethyl-2-isocyanatothiophene-3-carboxylate Traditional Name: 4,5-diethyl-2-isocyanato-thiophene-3-carboxylic acid methyl ester Formula: C11H13NO3S MolecularWeight: 239.29082

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=C1C(=O)OC)N=C=O)CC

Isomeric SMILES

CCC1=C(SC(=C1C(=O)OC)N=C=O)CC

InChI

InChI=1S/C11H13NO3S/c1-4-7-8(5-2)16-10(12-6-13)9(7)11(14)15-3/h4-5H2,1-3H3