ethyl 3-azanyl-5-methylsulfanyl-4-propan-2-ylsulfonyl-thiophene-2-carboxylate

Systemtic Name: ethyl 3-azanyl-5-methylsulfanyl-4-propan-2-ylsulfonyl-thiophene-2-carboxylate Openeye Name: ethyl 3-amino-4-isopropylsulfonyl-5-methylsulfanyl-thiophene-2-carboxylate CAS Name: 3-amino-5-(methylthio)-4-propan-2-ylsulfonyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 3-amino-5-methylsulfanyl-4-propan-2-ylsulfonylthiophene-2-carboxylate Traditional Name: 3-amino-4-isopropylsulfonyl-5-(methylthio)thiophene-2-carboxylic acid ethyl ester Formula: C11H17NO4S3 MolecularWeight: 323.45198

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)SC)S(=O)(=O)C(C)C)N

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)SC)S(=O)(=O)C(C)C)N

InChI

InChI=1S/C11H17NO4S3/c1-5-16-10(13)8-7(12)9(11(17-4)18-8)19(14,15)6(2)3/h6H,5,12H2,1-4H3