(3Z)-4-[[2-(3-bromophenyl)-2-oxidanyl-ethyl]amino]-3-(4-methyl-6-piperazin-1-yl-1,3-dihydrobenzimidazol-2-ylidene)pyridin-2-one

Systemtic Name: (3Z)-4-[[2-(3-bromophenyl)-2-oxidanyl-ethyl]amino]-3-(4-methyl-6-piperazin-1-yl-1,3-dihydrobenzimidazol-2-ylidene)pyridin-2-one Openeye Name: (3Z)-4-[[2-(3-bromophenyl)-2-hydroxy-ethyl]amino]-3-(4-methyl-6-piperazin-1-yl-1,3-dihydrobenzimidazol-2-ylidene)pyridin-2-one CAS Name: (3Z)-4-[[2-(3-bromophenyl)-2-hydroxyethyl]amino]-3-[4-methyl-6-(1-piperazinyl)-1,3-dihydrobenzimidazol-2-ylidene]-2-pyridinone IUPAC Name: (3Z)-4-[[2-(3-bromophenyl)-2-hydroxyethyl]amino]-3-(4-methyl-6-piperazin-1-yl-1,3-dihydrobenzimidazol-2-ylidene)pyridin-2-one Traditional Name: (3Z)-4-[[2-(3-bromophenyl)-2-hydroxy-ethyl]amino]-3-(4-methyl-6-piperazino-1,3-dihydrobenzimidazol-2-ylidene)-2-pyridone Formula: C25H27BrN6O2 MolecularWeight: 523.42488

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC2=C1NC(=C3C(=CC=NC3=O)NCC(C4=CC(=CC=C4)Br)O)N2)N5CCNCC5

Isomeric SMILES

CC1=CC(=CC2=C1N/C(=C\3/C(=CC=NC3=O)NCC(C4=CC(=CC=C4)Br)O)/N2)N5CCNCC5

InChI

InChI=1S/C25H27BrN6O2/c1-15-11-18(32-9-7-27-8-10-32)13-20-23(15)31-24(30-20)22-19(5-6-28-25(22)34)29-14-21(33)16-3-2-4-17(26)12-16/h2-6,11-13,21,27,29-31,33H,7-10,14H2,1H3/b24-22-