4-[[4-(5-fluoranyl-2-methoxy-phenyl)-1,4-diazepan-1-yl]methyl]-2-phenyl-1,3-thiazole

Systemtic Name: 4-[[4-(5-fluoranyl-2-methoxy-phenyl)-1,4-diazepan-1-yl]methyl]-2-phenyl-1,3-thiazole Openeye Name: 4-[[4-(5-fluoro-2-methoxy-phenyl)-1,4-diazepan-1-yl]methyl]-2-phenyl-thiazole CAS Name: 4-[[4-(5-fluoro-2-methoxyphenyl)-1,4-diazepan-1-yl]methyl]-2-phenylthiazole IUPAC Name: 4-[[4-(5-fluoro-2-methoxyphenyl)-1,4-diazepan-1-yl]methyl]-2-phenyl-1,3-thiazole Traditional Name: 4-[[4-(5-fluoro-2-methoxy-phenyl)-1,4-diazepan-1-yl]methyl]-2-phenyl-thiazole Formula: C22H24FN3OS MolecularWeight: 397.508863

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)F)N2CCCN(CC2)CC3=CSC(=N3)C4=CC=CC=C4

Isomeric SMILES

COC1=C(C=C(C=C1)F)N2CCCN(CC2)CC3=CSC(=N3)C4=CC=CC=C4

InChI

InChI=1S/C22H24FN3OS/c1-27-21-9-8-18(23)14-20(21)26-11-5-10-25(12-13-26)15-19-16-28-22(24-19)17-6-3-2-4-7-17/h2-4,6-9,14,16H,5,10-13,15H2,1H3