methyl 3-isocyanatosulfonyl-4-methylsulfanyl-thiophene-2-carboxylate

Systemtic Name: methyl 3-isocyanatosulfonyl-4-methylsulfanyl-thiophene-2-carboxylate Openeye Name: methyl 3-isocyanatosulfonyl-4-methylsulfanyl-thiophene-2-carboxylate CAS Name: 3-isocyanatosulfonyl-4-(methylthio)-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-isocyanatosulfonyl-4-methylsulfanylthiophene-2-carboxylate Traditional Name: 3-isocyanatosulfonyl-4-(methylthio)thiophene-2-carboxylic acid methyl ester Formula: C8H7NO5S3 MolecularWeight: 293.33988

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C(=CS1)SC)S(=O)(=O)N=C=O

Isomeric SMILES

COC(=O)C1=C(C(=CS1)SC)S(=O)(=O)N=C=O

InChI

InChI=1S/C8H7NO5S3/c1-14-8(11)6-7(5(15-2)3-16-6)17(12,13)9-4-10/h3H,1-2H3