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

Systemtic Name: (3Z)-4-[[2-(3-bromanyl-4-methoxy-phenyl)-2-oxidanyl-ethyl]amino]-3-[6-[4-(3-fluoranylpropyl)piperazin-1-yl]-4-methyl-1,3-dihydrobenzimidazol-2-ylidene]pyridin-2-one Openeye Name: (3Z)-4-[[2-(3-bromo-4-methoxy-phenyl)-2-hydroxy-ethyl]amino]-3-[6-[4-(3-fluoropropyl)piperazin-1-yl]-4-methyl-1,3-dihydrobenzimidazol-2-ylidene]pyridin-2-one CAS Name: (3Z)-4-[[2-(3-bromo-4-methoxyphenyl)-2-hydroxyethyl]amino]-3-[6-[4-(3-fluoropropyl)-1-piperazinyl]-4-methyl-1,3-dihydrobenzimidazol-2-ylidene]-2-pyridinone IUPAC Name: (3Z)-4-[[2-(3-bromo-4-methoxyphenyl)-2-hydroxyethyl]amino]-3-[6-[4-(3-fluoropropyl)piperazin-1-yl]-4-methyl-1,3-dihydrobenzimidazol-2-ylidene]pyridin-2-one Traditional Name: (3Z)-4-[[2-(3-bromo-4-methoxy-phenyl)-2-hydroxy-ethyl]amino]-3-[6-[4-(3-fluoropropyl)piperazino]-4-methyl-1,3-dihydrobenzimidazol-2-ylidene]-2-pyridone Formula: C29H34BrFN6O3 MolecularWeight: 613.521063

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC2=C1NC(=C3C(=CC=NC3=O)NCC(C4=CC(=C(C=C4)OC)Br)O)N2)N5CCN(CC5)CCCF

Isomeric SMILES

CC1=CC(=CC2=C1N/C(=C\3/C(=CC=NC3=O)NCC(C4=CC(=C(C=C4)OC)Br)O)/N2)N5CCN(CC5)CCCF

InChI

InChI=1S/C29H34BrFN6O3/c1-18-14-20(37-12-10-36(11-13-37)9-3-7-31)16-23-27(18)35-28(34-23)26-22(6-8-32-29(26)39)33-17-24(38)19-4-5-25(40-2)21(30)15-19/h4-6,8,14-16,24,33-35,38H,3,7,9-13,17H2,1-2H3/b28-26-