(3E)-3-[4-bromanyl-6-(morpholin-4-ylmethyl)-1,3-dihydrobenzimidazol-2-ylidene]-4-[[2-(3-chlorophenyl)-2-oxidanyl-ethyl]amino]pyridin-2-one

Systemtic Name: (3E)-3-[4-bromanyl-6-(morpholin-4-ylmethyl)-1,3-dihydrobenzimidazol-2-ylidene]-4-[[2-(3-chlorophenyl)-2-oxidanyl-ethyl]amino]pyridin-2-one Openeye Name: (3E)-3-[4-bromo-6-(morpholinomethyl)-1,3-dihydrobenzimidazol-2-ylidene]-4-[[2-(3-chlorophenyl)-2-hydroxy-ethyl]amino]pyridin-2-one CAS Name: (3E)-3-[4-bromo-6-(4-morpholinylmethyl)-1,3-dihydrobenzimidazol-2-ylidene]-4-[[2-(3-chlorophenyl)-2-hydroxyethyl]amino]-2-pyridinone IUPAC Name: (3E)-3-[4-bromo-6-(morpholin-4-ylmethyl)-1,3-dihydrobenzimidazol-2-ylidene]-4-[[2-(3-chlorophenyl)-2-hydroxyethyl]amino]pyridin-2-one Traditional Name: (3E)-3-[4-bromo-6-(morpholinomethyl)-1,3-dihydrobenzimidazol-2-ylidene]-4-[[2-(3-chlorophenyl)-2-hydroxy-ethyl]amino]-2-pyridone Formula: C25H25BrClN5O3 MolecularWeight: 558.8547

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CC2=CC3=C(C(=C2)Br)NC(=C4C(=CC=NC4=O)NCC(C5=CC(=CC=C5)Cl)O)N3

Isomeric SMILES

C1COCCN1CC2=CC3=C(C(=C2)Br)N/C(=C/4\C(=CC=NC4=O)NCC(C5=CC(=CC=C5)Cl)O)/N3

InChI

InChI=1S/C25H25BrClN5O3/c26-18-10-15(14-32-6-8-35-9-7-32)11-20-23(18)31-24(30-20)22-19(4-5-28-25(22)34)29-13-21(33)16-2-1-3-17(27)12-16/h1-5,10-12,21,29-31,33H,6-9,13-14H2/b24-22+