7-[4-(2-azanylpropanoyl)piperazin-1-yl]-5-cyclopropyl-8-fluoranyl-2-oxidanyl-pyrimido[1,6-a]benzimidazole-1,3-dione

Systemtic Name: 7-[4-(2-azanylpropanoyl)piperazin-1-yl]-5-cyclopropyl-8-fluoranyl-2-oxidanyl-pyrimido[1,6-a]benzimidazole-1,3-dione Openeye Name: 7-[4-(2-aminopropanoyl)piperazin-1-yl]-5-cyclopropyl-8-fluoro-2-hydroxy-pyrimido[1,6-a]benzimidazole-1,3-dione CAS Name: 7-[4-(2-amino-1-oxopropyl)-1-piperazinyl]-5-cyclopropyl-8-fluoro-2-hydroxypyrimido[1,6-a]benzimidazole-1,3-dione IUPAC Name: 7-[4-(2-aminopropanoyl)piperazin-1-yl]-5-cyclopropyl-8-fluoro-2-hydroxypyrimido[1,6-a]benzimidazole-1,3-dione Traditional Name: 7-(4-alanylpiperazino)-5-cyclopropyl-8-fluoro-2-hydroxy-pyrimido[1,6-a]benzimidazole-1,3-quinone Formula: C20H23FN6O4 MolecularWeight: 430.432823

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)C2=C(C=C3C(=C2)N(C4=CC(=O)N(C(=O)N34)O)C5CC5)F)N

Isomeric SMILES

CC(C(=O)N1CCN(CC1)C2=C(C=C3C(=C2)N(C4=CC(=O)N(C(=O)N34)O)C5CC5)F)N

InChI

InChI=1S/C20H23FN6O4/c1-11(22)19(29)24-6-4-23(5-7-24)14-9-16-15(8-13(14)21)26-17(25(16)12-2-3-12)10-18(28)27(31)20(26)30/h8-12,31H,2-7,22H2,1H3