1-[2-[4-(6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)butoxy]pyrimidin-4-yl]-2-[2,2,2-tris(fluoranyl)ethyl]guanidine

Systemtic Name: 1-[2-[4-(6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)butoxy]pyrimidin-4-yl]-2-[2,2,2-tris(fluoranyl)ethyl]guanidine Openeye Name: 1-[2-[4-(6-methyl-4-oxo-1H-pyrimidin-2-yl)butoxy]pyrimidin-4-yl]-2-(2,2,2-trifluoroethyl)guanidine CAS Name: 1-[2-[4-(6-methyl-4-oxo-1H-pyrimidin-2-yl)butoxy]-4-pyrimidinyl]-2-(2,2,2-trifluoroethyl)guanidine IUPAC Name: 1-[2-[4-(6-methyl-4-oxo-1H-pyrimidin-2-yl)butoxy]pyrimidin-4-yl]-2-(2,2,2-trifluoroethyl)guanidine Traditional Name: 1-[2-[4-(4-keto-6-methyl-1H-pyrimidin-2-yl)butoxy]pyrimidin-4-yl]-2-(2,2,2-trifluoroethyl)guanidine Formula: C16H20F3N7O2 MolecularWeight: 399.37091

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N=C(N1)CCCCOC2=NC=CC(=N2)NC(=NCC(F)(F)F)N

Isomeric SMILES

CC1=CC(=O)N=C(N1)CCCCOC2=NC=CC(=N2)NC(=NCC(F)(F)F)N

InChI

InChI=1S/C16H20F3N7O2/c1-10-8-13(27)24-11(23-10)4-2-3-7-28-15-21-6-5-12(26-15)25-14(20)22-9-16(17,18)19/h5-6,8H,2-4,7,9H2,1H3,(H,23,24,27)(H3,20,21,22,25,26)