(6Z)-4-fluoranyl-6-[[[(2R)-1-(1H-imidazol-5-yl)propan-2-yl]amino]-pyridin-4-yl-methylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: (6Z)-4-fluoranyl-6-[[[(2R)-1-(1H-imidazol-5-yl)propan-2-yl]amino]-pyridin-4-yl-methylidene]cyclohexa-2,4-dien-1-one Openeye Name: (6Z)-4-fluoro-6-[[[(1R)-2-(1H-imidazol-5-yl)-1-methyl-ethyl]amino]-(4-pyridyl)methylene]cyclohexa-2,4-dien-1-one CAS Name: (6Z)-4-fluoro-6-[[[(2R)-1-(1H-imidazol-5-yl)propan-2-yl]amino]-pyridin-4-ylmethylidene]-1-cyclohexa-2,4-dienone IUPAC Name: (6Z)-4-fluoro-6-[[[(2R)-1-(1H-imidazol-5-yl)propan-2-yl]amino]-pyridin-4-ylmethylidene]cyclohexa-2,4-dien-1-one Traditional Name: (6Z)-4-fluoro-6-[[[(1R)-2-(1H-imidazol-5-yl)-1-methyl-ethyl]amino]-(4-pyridyl)methylene]cyclohexa-2,4-dien-1-one Formula: C18H17FN4O MolecularWeight: 324.352183

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CN=CN1)NC(=C2C=C(C=CC2=O)F)C3=CC=NC=C3

Isomeric SMILES

C[C@H](CC1=CN=CN1)N/C(=C\2/C=C(C=CC2=O)F)/C3=CC=NC=C3

InChI

InChI=1S/C18H17FN4O/c1-12(8-15-10-21-11-22-15)23-18(13-4-6-20-7-5-13)16-9-14(19)2-3-17(16)24/h2-7,9-12,23H,8H2,1H3,(H,21,22)/b18-16-/t12-/m1/s1