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

Systemtic Name: ethyl 3-isocyanatosulfonyl-4-methylsulfanyl-thiophene-2-carboxylate Openeye Name: ethyl 3-isocyanatosulfonyl-4-methylsulfanyl-thiophene-2-carboxylate CAS Name: 3-isocyanatosulfonyl-4-(methylthio)-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 3-isocyanatosulfonyl-4-methylsulfanylthiophene-2-carboxylate Traditional Name: 3-isocyanatosulfonyl-4-(methylthio)thiophene-2-carboxylic acid ethyl ester Formula: C9H9NO5S3 MolecularWeight: 307.36646

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H9NO5S3/c1-3-15-9(12)7-8(6(16-2)4-17-7)18(13,14)10-5-11/h4H,3H2,1-2H3