N-[(4-fluorophenyl)methyl]-2-[(2S)-2-methyl-4-oxidanylidene-2,3-dihydro-1,5-benzothiazepin-5-yl]ethanamide

Systemtic Name: N-[(4-fluorophenyl)methyl]-2-[(2S)-2-methyl-4-oxidanylidene-2,3-dihydro-1,5-benzothiazepin-5-yl]ethanamide Openeye Name: N-[(4-fluorophenyl)methyl]-2-[(2S)-2-methyl-4-oxo-2,3-dihydro-1,5-benzothiazepin-5-yl]acetamide CAS Name: N-[(4-fluorophenyl)methyl]-2-[(2S)-2-methyl-4-oxo-2,3-dihydro-1,5-benzothiazepin-5-yl]acetamide IUPAC Name: N-[(4-fluorophenyl)methyl]-2-[(2S)-2-methyl-4-oxo-2,3-dihydro-1,5-benzothiazepin-5-yl]acetamide Traditional Name: N-(4-fluorobenzyl)-2-[(2S)-4-keto-2-methyl-2,3-dihydro-1,5-benzothiazepin-5-yl]acetamide Formula: C19H19FN2O2S MolecularWeight: 358.429763

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)N(C2=CC=CC=C2S1)CC(=O)NCC3=CC=C(C=C3)F

Isomeric SMILES

C[C@H]1CC(=O)N(C2=CC=CC=C2S1)CC(=O)NCC3=CC=C(C=C3)F

InChI

InChI=1S/C19H19FN2O2S/c1-13-10-19(24)22(16-4-2-3-5-17(16)25-13)12-18(23)21-11-14-6-8-15(20)9-7-14/h2-9,13H,10-12H2,1H3,(H,21,23)/t13-/m0/s1