(6aR,7R)-2-fluoranyl-7-(4-methylphenyl)-6a,7-dihydro-6H-chromeno[3,4-c][1,5]benzothiazepine

Systemtic Name: (6aR,7R)-2-fluoranyl-7-(4-methylphenyl)-6a,7-dihydro-6H-chromeno[3,4-c][1,5]benzothiazepine Openeye Name: (6aR,7R)-2-fluoro-7-(p-tolyl)-6a,7-dihydro-6H-chromeno[3,4-c][1,5]benzothiazepine CAS Name: (6aR,7R)-2-fluoro-7-(4-methylphenyl)-6a,7-dihydro-6H-[1]benzopyrano[3,4-c][1,5]benzothiazepine IUPAC Name: (6aR,7R)-2-fluoro-7-(4-methylphenyl)-6a,7-dihydro-6H-chromeno[3,4-c][1,5]benzothiazepine Traditional Name: (6aR,7R)-2-fluoro-7-(p-tolyl)-6a,7-dihydro-6H-chromeno[3,4-c][1,5]benzothiazepine Formula: C23H18FNOS MolecularWeight: 375.458523

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2C3COC4=C(C3=NC5=CC=CC=C5S2)C=C(C=C4)F

Isomeric SMILES

CC1=CC=C(C=C1)[C@H]2[C@H]3COC4=C(C3=NC5=CC=CC=C5S2)C=C(C=C4)F

InChI

InChI=1S/C23H18FNOS/c1-14-6-8-15(9-7-14)23-18-13-26-20-11-10-16(24)12-17(20)22(18)25-19-4-2-3-5-21(19)27-23/h2-12,18,23H,13H2,1H3/t18-,23-/m0/s1