ethyl 2-azanyl-7-oxidanylidene-6-phenylsulfanyl-5,6-dihydro-4H-1-benzothiophene-3-carboxylate

Systemtic Name: ethyl 2-azanyl-7-oxidanylidene-6-phenylsulfanyl-5,6-dihydro-4H-1-benzothiophene-3-carboxylate Openeye Name: ethyl 2-amino-7-oxo-6-phenylsulfanyl-5,6-dihydro-4H-benzothiophene-3-carboxylate CAS Name: 2-amino-7-oxo-6-(phenylthio)-5,6-dihydro-4H-1-benzothiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-amino-7-oxo-6-phenylsulfanyl-5,6-dihydro-4H-1-benzothiophene-3-carboxylate Traditional Name: 2-amino-7-keto-6-(phenylthio)-5,6-dihydro-4H-benzothiophene-3-carboxylic acid ethyl ester Formula: C17H17NO3S2 MolecularWeight: 347.45178

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=C1CCC(C2=O)SC3=CC=CC=C3)N

Isomeric SMILES

CCOC(=O)C1=C(SC2=C1CCC(C2=O)SC3=CC=CC=C3)N

InChI

InChI=1S/C17H17NO3S2/c1-2-21-17(20)13-11-8-9-12(14(19)15(11)23-16(13)18)22-10-6-4-3-5-7-10/h3-7,12H,2,8-9,18H2,1H3