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

Systemtic Name: 5-chloranyl-4-[[4-(2-methoxyphenyl)-1,4-diazepan-1-yl]methyl]-2-phenyl-1,3-thiazole Openeye Name: 5-chloro-4-[[4-(2-methoxyphenyl)-1,4-diazepan-1-yl]methyl]-2-phenyl-thiazole CAS Name: 5-chloro-4-[[4-(2-methoxyphenyl)-1,4-diazepan-1-yl]methyl]-2-phenylthiazole IUPAC Name: 5-chloro-4-[[4-(2-methoxyphenyl)-1,4-diazepan-1-yl]methyl]-2-phenyl-1,3-thiazole Traditional Name: 5-chloro-4-[[4-(2-methoxyphenyl)-1,4-diazepan-1-yl]methyl]-2-phenyl-thiazole Formula: C22H24ClN3OS MolecularWeight: 413.96346

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCCN(CC2)CC3=C(SC(=N3)C4=CC=CC=C4)Cl

Isomeric SMILES

COC1=CC=CC=C1N2CCCN(CC2)CC3=C(SC(=N3)C4=CC=CC=C4)Cl

InChI

InChI=1S/C22H24ClN3OS/c1-27-20-11-6-5-10-19(20)26-13-7-12-25(14-15-26)16-18-21(23)28-22(24-18)17-8-3-2-4-9-17/h2-6,8-11H,7,12-16H2,1H3