2-(3-chloranyl-4-fluoranyl-phenoxy)-1-[(2S)-2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl]ethanone

Systemtic Name: 2-(3-chloranyl-4-fluoranyl-phenoxy)-1-[(2S)-2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl]ethanone Openeye Name: 2-(3-chloro-4-fluoro-phenoxy)-1-[(2S)-2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl]ethanone CAS Name: 2-(3-chloro-4-fluorophenoxy)-1-[(2S)-2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl]ethanone IUPAC Name: 2-(3-chloro-4-fluorophenoxy)-1-[(2S)-2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl]ethanone Traditional Name: 2-(3-chloro-4-fluoro-phenoxy)-1-[(2S)-2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl]ethanone Formula: C18H17ClFNO2S MolecularWeight: 365.849483

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(C2=CC=CC=C2S1)C(=O)COC3=CC(=C(C=C3)F)Cl

Isomeric SMILES

C[C@H]1CCN(C2=CC=CC=C2S1)C(=O)COC3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C18H17ClFNO2S/c1-12-8-9-21(16-4-2-3-5-17(16)24-12)18(22)11-23-13-6-7-15(20)14(19)10-13/h2-7,10,12H,8-9,11H2,1H3/t12-/m0/s1