N-[6-azanyl-1-(2-methylpropyl)-2,4-bis(oxidanylidene)pyrimidin-5-yl]-N-butyl-7-fluoranyl-2-methyl-quinoline-4-carboxamide

Systemtic Name: N-[6-azanyl-1-(2-methylpropyl)-2,4-bis(oxidanylidene)pyrimidin-5-yl]-N-butyl-7-fluoranyl-2-methyl-quinoline-4-carboxamide Openeye Name: N-(6-amino-1-isobutyl-2,4-dioxo-pyrimidin-5-yl)-N-butyl-7-fluoro-2-methyl-quinoline-4-carboxamide CAS Name: N-[6-amino-1-(2-methylpropyl)-2,4-dioxo-5-pyrimidinyl]-N-butyl-7-fluoro-2-methyl-4-quinolinecarboxamide IUPAC Name: N-[6-amino-1-(2-methylpropyl)-2,4-dioxopyrimidin-5-yl]-N-butyl-7-fluoro-2-methylquinoline-4-carboxamide Traditional Name: N-(6-amino-1-isobutyl-2,4-diketo-pyrimidin-5-yl)-N-butyl-7-fluoro-2-methyl-cinchoninamide Formula: C23H28FN5O3 MolecularWeight: 441.498523

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1=C(N(C(=O)NC1=O)CC(C)C)N)C(=O)C2=CC(=NC3=C2C=CC(=C3)F)C

Isomeric SMILES

CCCCN(C1=C(N(C(=O)NC1=O)CC(C)C)N)C(=O)C2=CC(=NC3=C2C=CC(=C3)F)C

InChI

InChI=1S/C23H28FN5O3/c1-5-6-9-28(19-20(25)29(12-13(2)3)23(32)27-21(19)30)22(31)17-10-14(4)26-18-11-15(24)7-8-16(17)18/h7-8,10-11,13H,5-6,9,12,25H2,1-4H3,(H,27,30,32)