3-fluoranyl-N,N-di(propan-2-yl)-5,6-dihydrobenzo[b][1]benzothiepine-7-carboxamide

Systemtic Name: 3-fluoranyl-N,N-di(propan-2-yl)-5,6-dihydrobenzo[b][1]benzothiepine-7-carboxamide Openeye Name: 3-fluoro-N,N-diisopropyl-5,6-dihydrobenzo[b][1]benzothiepine-7-carboxamide CAS Name: 3-fluoro-N,N-di(propan-2-yl)-5,6-dihydrobenzo[b][1]benzothiepin-7-carboxamide IUPAC Name: 3-fluoro-N,N-di(propan-2-yl)-5,6-dihydrobenzo[b][1]benzothiepine-7-carboxamide Traditional Name: 3-fluoro-N,N-diisopropyl-5,6-dihydrobenzo[b][1]benzothiepin-7-carboxamide Formula: C21H24FNOS MolecularWeight: 357.484763

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C(C)C)C(=O)C1=C2CCC3=C(C=CC(=C3)F)SC2=CC=C1

Isomeric SMILES

CC(C)N(C(C)C)C(=O)C1=C2CCC3=C(C=CC(=C3)F)SC2=CC=C1

InChI

InChI=1S/C21H24FNOS/c1-13(2)23(14(3)4)21(24)18-6-5-7-20-17(18)10-8-15-12-16(22)9-11-19(15)25-20/h5-7,9,11-14H,8,10H2,1-4H3