7-(1,3-benzothiazol-2-yl)-4-[(4-fluorophenyl)methyl]-9-methoxy-3,5-dihydro-2H-1,4-benzoxazepine

Systemtic Name: 7-(1,3-benzothiazol-2-yl)-4-[(4-fluorophenyl)methyl]-9-methoxy-3,5-dihydro-2H-1,4-benzoxazepine Openeye Name: 7-(1,3-benzothiazol-2-yl)-4-[(4-fluorophenyl)methyl]-9-methoxy-3,5-dihydro-2H-1,4-benzoxazepine CAS Name: 7-(1,3-benzothiazol-2-yl)-4-[(4-fluorophenyl)methyl]-9-methoxy-3,5-dihydro-2H-1,4-benzoxazepine IUPAC Name: 7-(1,3-benzothiazol-2-yl)-4-[(4-fluorophenyl)methyl]-9-methoxy-3,5-dihydro-2H-1,4-benzoxazepine Traditional Name: 7-(1,3-benzothiazol-2-yl)-4-(4-fluorobenzyl)-9-methoxy-3,5-dihydro-2H-1,4-benzoxazepine Formula: C24H21FN2O2S MolecularWeight: 420.499143

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC2=C1OCCN(C2)CC3=CC=C(C=C3)F)C4=NC5=CC=CC=C5S4

Isomeric SMILES

COC1=CC(=CC2=C1OCCN(C2)CC3=CC=C(C=C3)F)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C24H21FN2O2S/c1-28-21-13-17(24-26-20-4-2-3-5-22(20)30-24)12-18-15-27(10-11-29-23(18)21)14-16-6-8-19(25)9-7-16/h2-9,12-13H,10-11,14-15H2,1H3