methyl 3-(5,6,7,8-tetrahydronaphthalen-2-ylcarbonylamino)-1-benzothiophene-2-carboxylate

Systemtic Name: methyl 3-(5,6,7,8-tetrahydronaphthalen-2-ylcarbonylamino)-1-benzothiophene-2-carboxylate Openeye Name: methyl 3-(tetralin-6-carbonylamino)benzothiophene-2-carboxylate CAS Name: 3-[[oxo(5,6,7,8-tetrahydronaphthalen-2-yl)methyl]amino]-1-benzothiophene-2-carboxylic acid methyl ester IUPAC Name: methyl 3-(5,6,7,8-tetrahydronaphthalene-2-carbonylamino)-1-benzothiophene-2-carboxylate Traditional Name: 3-(tetralin-6-carbonylamino)benzothiophene-2-carboxylic acid methyl ester Formula: C21H19NO3S MolecularWeight: 365.44546

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C2=CC=CC=C2S1)NC(=O)C3=CC4=C(CCCC4)C=C3

Isomeric SMILES

COC(=O)C1=C(C2=CC=CC=C2S1)NC(=O)C3=CC4=C(CCCC4)C=C3

InChI

InChI=1S/C21H19NO3S/c1-25-21(24)19-18(16-8-4-5-9-17(16)26-19)22-20(23)15-11-10-13-6-2-3-7-14(13)12-15/h4-5,8-12H,2-3,6-7H2,1H3,(H,22,23)