methyl 6-(phenylmethyl)-4,5,7,8-tetrahydrothieno[2,3-d]azepine-4-carboxylate

Systemtic Name: methyl 6-(phenylmethyl)-4,5,7,8-tetrahydrothieno[2,3-d]azepine-4-carboxylate Openeye Name: methyl 6-benzyl-4,5,7,8-tetrahydrothieno[2,3-d]azepine-4-carboxylate CAS Name: 6-(phenylmethyl)-4,5,7,8-tetrahydrothieno[2,3-d]azepine-4-carboxylic acid methyl ester IUPAC Name: methyl 6-benzyl-4,5,7,8-tetrahydrothieno[2,3-d]azepine-4-carboxylate Traditional Name: 6-benzyl-4,5,7,8-tetrahydrothien[2,3-d]azepine-4-carboxylic acid methyl ester Formula: C17H19NO2S MolecularWeight: 301.40326

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CN(CCC2=C1C=CS2)CC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1CN(CCC2=C1C=CS2)CC3=CC=CC=C3

InChI

InChI=1S/C17H19NO2S/c1-20-17(19)15-12-18(11-13-5-3-2-4-6-13)9-7-16-14(15)8-10-21-16/h2-6,8,10,15H,7,9,11-12H2,1H3