6-chloranyl-3-[1-[(5-phenyl-4,5-dihydro-1,2-oxazol-3-yl)methyl]piperidin-4-yl]-1H-benzimidazole-2-thione

Systemtic Name: 6-chloranyl-3-[1-[(5-phenyl-4,5-dihydro-1,2-oxazol-3-yl)methyl]piperidin-4-yl]-1H-benzimidazole-2-thione Openeye Name: 6-chloro-3-[1-[(5-phenyl-4,5-dihydroisoxazol-3-yl)methyl]-4-piperidyl]-1H-benzimidazole-2-thione CAS Name: 6-chloro-3-[1-[(5-phenyl-4,5-dihydroisoxazol-3-yl)methyl]-4-piperidinyl]-1H-benzimidazole-2-thione IUPAC Name: 6-chloro-3-[1-[(5-phenyl-4,5-dihydro-1,2-oxazol-3-yl)methyl]piperidin-4-yl]-1H-benzimidazole-2-thione Traditional Name: 6-chloro-3-[1-[(5-phenyl-2-isoxazolin-3-yl)methyl]-4-piperidyl]-1H-benzimidazole-2-thione Formula: C22H23ClN4OS MolecularWeight: 426.96222

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2C3=C(C=C(C=C3)Cl)NC2=S)CC4=NOC(C4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1N2C3=C(C=C(C=C3)Cl)NC2=S)CC4=NOC(C4)C5=CC=CC=C5

InChI

InChI=1S/C22H23ClN4OS/c23-16-6-7-20-19(12-16)24-22(29)27(20)18-8-10-26(11-9-18)14-17-13-21(28-25-17)15-4-2-1-3-5-15/h1-7,12,18,21H,8-11,13-14H2,(H,24,29)