2-methyl-6-oxidanylidene-4-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)-1-[2,2,2-tris(fluoranyl)ethoxy]pyrimidine-5-carbonitrile

Systemtic Name: 2-methyl-6-oxidanylidene-4-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)-1-[2,2,2-tris(fluoranyl)ethoxy]pyrimidine-5-carbonitrile Openeye Name: 2-methyl-6-oxo-4-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)-1-(2,2,2-trifluoroethoxy)pyrimidine-5-carbonitrile CAS Name: 2-methyl-6-oxo-4-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)-1-(2,2,2-trifluoroethoxy)-5-pyrimidinecarbonitrile IUPAC Name: 2-methyl-6-oxo-4-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)-1-(2,2,2-trifluoroethoxy)pyrimidine-5-carbonitrile Traditional Name: 6-keto-2-methyl-4-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)-1-(2,2,2-trifluoroethoxy)pyrimidine-5-carbonitrile Formula: C18H17F3N4O2 MolecularWeight: 378.34839

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(=O)N1OCC(F)(F)F)C#N)N2CCC3=CC=CC=C3CC2

Isomeric SMILES

CC1=NC(=C(C(=O)N1OCC(F)(F)F)C#N)N2CCC3=CC=CC=C3CC2

InChI

InChI=1S/C18H17F3N4O2/c1-12-23-16(15(10-22)17(26)25(12)27-11-18(19,20)21)24-8-6-13-4-2-3-5-14(13)7-9-24/h2-5H,6-9,11H2,1H3