(2R)-2-(2-fluorophenyl)-5-(1H-imidazol-2-ylmethyl)-8-methoxy-3,4-dihydro-2H-1,5-benzothiazepine

Systemtic Name: (2R)-2-(2-fluorophenyl)-5-(1H-imidazol-2-ylmethyl)-8-methoxy-3,4-dihydro-2H-1,5-benzothiazepine Openeye Name: (2R)-2-(2-fluorophenyl)-5-(1H-imidazol-2-ylmethyl)-8-methoxy-3,4-dihydro-2H-1,5-benzothiazepine CAS Name: (2R)-2-(2-fluorophenyl)-5-(1H-imidazol-2-ylmethyl)-8-methoxy-3,4-dihydro-2H-1,5-benzothiazepine IUPAC Name: (2R)-2-(2-fluorophenyl)-5-(1H-imidazol-2-ylmethyl)-8-methoxy-3,4-dihydro-2H-1,5-benzothiazepine Traditional Name: (2R)-2-(2-fluorophenyl)-5-(1H-imidazol-2-ylmethyl)-8-methoxy-3,4-dihydro-2H-1,5-benzothiazepine Formula: C20H20FN3OS MolecularWeight: 369.455703

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N(CCC(S2)C3=CC=CC=C3F)CC4=NC=CN4

Isomeric SMILES

COC1=CC2=C(C=C1)N(CC[C@@H](S2)C3=CC=CC=C3F)CC4=NC=CN4

InChI

InChI=1S/C20H20FN3OS/c1-25-14-6-7-17-19(12-14)26-18(15-4-2-3-5-16(15)21)8-11-24(17)13-20-22-9-10-23-20/h2-7,9-10,12,18H,8,11,13H2,1H3,(H,22,23)/t18-/m1/s1