ethyl 4-(3,4-dihydro-2H-thiochromen-4-yl)-1,4-diazepane-1-carboxylate

Systemtic Name: ethyl 4-(3,4-dihydro-2H-thiochromen-4-yl)-1,4-diazepane-1-carboxylate Openeye Name: ethyl 4-thiochroman-4-yl-1,4-diazepane-1-carboxylate CAS Name: 4-(3,4-dihydro-2H-1-benzothiopyran-4-yl)-1,4-diazepane-1-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(3,4-dihydro-2H-thiochromen-4-yl)-1,4-diazepane-1-carboxylate Traditional Name: 4-thiochroman-4-yl-1,4-diazepane-1-carboxylic acid ethyl ester Formula: C17H24N2O2S MolecularWeight: 320.44966

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCCN(CC1)C2CCSC3=CC=CC=C23

Isomeric SMILES

CCOC(=O)N1CCCN(CC1)C2CCSC3=CC=CC=C23

InChI

InChI=1S/C17H24N2O2S/c1-2-21-17(20)19-10-5-9-18(11-12-19)15-8-13-22-16-7-4-3-6-14(15)16/h3-4,6-7,15H,2,5,8-13H2,1H3