N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-N-pentyl-4-(trifluoromethyloxy)benzamide

Systemtic Name: N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-N-pentyl-4-(trifluoromethyloxy)benzamide Openeye Name: N-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-N-pentyl-4-(trifluoromethoxy)benzamide CAS Name: N-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-N-pentyl-4-(trifluoromethoxy)benzamide IUPAC Name: N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-N-pentyl-4-(trifluoromethoxy)benzamide Traditional Name: N-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-N-amyl-4-(trifluoromethoxy)benzamide Formula: C21H27F3N4O4 MolecularWeight: 456.45869

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(C1=C(N(C(=O)NC1=O)CCCC)N)C(=O)C2=CC=C(C=C2)OC(F)(F)F

Isomeric SMILES

CCCCCN(C1=C(N(C(=O)NC1=O)CCCC)N)C(=O)C2=CC=C(C=C2)OC(F)(F)F

InChI

InChI=1S/C21H27F3N4O4/c1-3-5-7-13-27(16-17(25)28(12-6-4-2)20(31)26-18(16)29)19(30)14-8-10-15(11-9-14)32-21(22,23)24/h8-11H,3-7,12-13,25H2,1-2H3,(H,26,29,31)