ethyl 2-(2-aminophenyl)sulfanyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name: ethyl 2-(2-aminophenyl)sulfanyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: ethyl 2-(2-aminophenyl)sulfanyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: 2-[(2-aminophenyl)thio]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-(2-aminophenyl)sulfanyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: 2-[(2-aminophenyl)thio]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid ethyl ester Formula: C17H19NO2S2 MolecularWeight: 333.46826

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=C1CCCC2)SC3=CC=CC=C3N

Isomeric SMILES

CCOC(=O)C1=C(SC2=C1CCCC2)SC3=CC=CC=C3N

InChI

InChI=1S/C17H19NO2S2/c1-2-20-16(19)15-11-7-3-5-9-13(11)21-17(15)22-14-10-6-4-8-12(14)18/h4,6,8,10H,2-3,5,7,9,18H2,1H3