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

Systemtic Name: 4-[[4-[(2-bromanyl-4,5-dimethoxy-phenyl)methyl]-1,4-diazepan-1-yl]methyl]-2-methyl-1,3-thiazole Openeye Name: 4-[[4-[(2-bromo-4,5-dimethoxy-phenyl)methyl]-1,4-diazepan-1-yl]methyl]-2-methyl-thiazole CAS Name: 4-[[4-[(2-bromo-4,5-dimethoxyphenyl)methyl]-1,4-diazepan-1-yl]methyl]-2-methylthiazole IUPAC Name: 4-[[4-[(2-bromo-4,5-dimethoxyphenyl)methyl]-1,4-diazepan-1-yl]methyl]-2-methyl-1,3-thiazole Traditional Name: 4-[[4-(2-bromo-4,5-dimethoxy-benzyl)-1,4-diazepan-1-yl]methyl]-2-methyl-thiazole Formula: C19H26BrN3O2S MolecularWeight: 440.39764

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)CN2CCCN(CC2)CC3=CC(=C(C=C3Br)OC)OC

Isomeric SMILES

CC1=NC(=CS1)CN2CCCN(CC2)CC3=CC(=C(C=C3Br)OC)OC

InChI

InChI=1S/C19H26BrN3O2S/c1-14-21-16(13-26-14)12-23-6-4-5-22(7-8-23)11-15-9-18(24-2)19(25-3)10-17(15)20/h9-10,13H,4-8,11-12H2,1-3H3