ethyl 2-azanyl-7-oxidanyl-6-(phenylsulfinyl)-1-benzothiophene-3-carboxylate

Systemtic Name: ethyl 2-azanyl-7-oxidanyl-6-(phenylsulfinyl)-1-benzothiophene-3-carboxylate Openeye Name: ethyl 2-amino-6-(benzenesulfinyl)-7-hydroxy-benzothiophene-3-carboxylate CAS Name: 2-amino-6-(benzenesulfinyl)-7-hydroxy-1-benzothiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-amino-6-(benzenesulfinyl)-7-hydroxy-1-benzothiophene-3-carboxylate Traditional Name: 2-amino-6-(benzenesulfinyl)-7-hydroxy-benzothiophene-3-carboxylic acid ethyl ester Formula: C17H15NO4S2 MolecularWeight: 361.4353

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=C1C=CC(=C2O)S(=O)C3=CC=CC=C3)N

Isomeric SMILES

CCOC(=O)C1=C(SC2=C1C=CC(=C2O)S(=O)C3=CC=CC=C3)N

InChI

InChI=1S/C17H15NO4S2/c1-2-22-17(20)13-11-8-9-12(14(19)15(11)23-16(13)18)24(21)10-6-4-3-5-7-10/h3-9,19H,2,18H2,1H3