5-azanyl-1-[6-[[4-(trifluoromethyloxy)phenyl]amino]pyrimidin-4-yl]pyrazole-4-carbonitrile

Systemtic Name: 5-azanyl-1-[6-[[4-(trifluoromethyloxy)phenyl]amino]pyrimidin-4-yl]pyrazole-4-carbonitrile Openeye Name: 5-amino-1-[6-[4-(trifluoromethoxy)anilino]pyrimidin-4-yl]pyrazole-4-carbonitrile CAS Name: 5-amino-1-[6-[4-(trifluoromethoxy)anilino]-4-pyrimidinyl]-4-pyrazolecarbonitrile IUPAC Name: 5-amino-1-[6-[4-(trifluoromethoxy)anilino]pyrimidin-4-yl]pyrazole-4-carbonitrile Traditional Name: 5-amino-1-[6-[4-(trifluoromethoxy)anilino]pyrimidin-4-yl]pyrazole-4-carbonitrile Formula: C15H10F3N7O MolecularWeight: 361.28141

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC2=NC=NC(=C2)N3C(=C(C=N3)C#N)N)OC(F)(F)F

Isomeric SMILES

C1=CC(=CC=C1NC2=NC=NC(=C2)N3C(=C(C=N3)C#N)N)OC(F)(F)F

InChI

InChI=1S/C15H10F3N7O/c16-15(17,18)26-11-3-1-10(2-4-11)24-12-5-13(22-8-21-12)25-14(20)9(6-19)7-23-25/h1-5,7-8H,20H2,(H,21,22,24)