2-azanyl-3-[(E)-(2-prop-2-ynoxyphenyl)methylideneamino]-6-(trifluoromethyl)pyrimidin-4-one

Systemtic Name: 2-azanyl-3-[(E)-(2-prop-2-ynoxyphenyl)methylideneamino]-6-(trifluoromethyl)pyrimidin-4-one Openeye Name: 2-amino-3-[(E)-(2-prop-2-ynoxyphenyl)methyleneamino]-6-(trifluoromethyl)pyrimidin-4-one CAS Name: 2-amino-3-[(E)-(2-prop-2-ynoxyphenyl)methylideneamino]-6-(trifluoromethyl)-4-pyrimidinone IUPAC Name: 2-amino-3-[(E)-(2-prop-2-ynoxyphenyl)methylideneamino]-6-(trifluoromethyl)pyrimidin-4-one Traditional Name: 2-amino-3-[(E)-(2-propargyloxybenzylidene)amino]-6-(trifluoromethyl)pyrimidin-4-one Formula: C15H11F3N4O2 MolecularWeight: 336.26865

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Descriptors Computed from Structure

Canonical SMILES:

C#CCOC1=CC=CC=C1C=NN2C(=O)C=C(N=C2N)C(F)(F)F

Isomeric SMILES

C#CCOC1=CC=CC=C1/C=N/N2C(=O)C=C(N=C2N)C(F)(F)F

InChI

InChI=1S/C15H11F3N4O2/c1-2-7-24-11-6-4-3-5-10(11)9-20-22-13(23)8-12(15(16,17)18)21-14(22)19/h1,3-6,8-9H,7H2,(H2,19,21)/b20-9+