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

Systemtic Name: ethyl 7-(phenylmethyl)-4,5,6,8-tetrahydrothieno[2,3-c]azepine-2-carboxylate Openeye Name: ethyl 7-benzyl-4,5,6,8-tetrahydrothieno[2,3-c]azepine-2-carboxylate CAS Name: 7-(phenylmethyl)-4,5,6,8-tetrahydrothieno[2,3-c]azepine-2-carboxylic acid ethyl ester IUPAC Name: ethyl 7-benzyl-4,5,6,8-tetrahydrothieno[2,3-c]azepine-2-carboxylate Traditional Name: 7-benzyl-4,5,6,8-tetrahydrothien[2,3-c]azepine-2-carboxylic acid ethyl ester Formula: C18H21NO2S MolecularWeight: 315.42984

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(S1)CN(CCC2)CC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=CC2=C(S1)CN(CCC2)CC3=CC=CC=C3

InChI

InChI=1S/C18H21NO2S/c1-2-21-18(20)16-11-15-9-6-10-19(13-17(15)22-16)12-14-7-4-3-5-8-14/h3-5,7-8,11H,2,6,9-10,12-13H2,1H3