5-[(3-chloranyl-4-fluoranyl-phenyl)amino]-1,3-dimethyl-6-prop-2-enyl-pyrazolo[4,3-d]pyrimidin-7-one

Systemtic Name: 5-[(3-chloranyl-4-fluoranyl-phenyl)amino]-1,3-dimethyl-6-prop-2-enyl-pyrazolo[4,3-d]pyrimidin-7-one Openeye Name: 6-allyl-5-(3-chloro-4-fluoro-anilino)-1,3-dimethyl-pyrazolo[4,3-d]pyrimidin-7-one CAS Name: 5-(3-chloro-4-fluoroanilino)-1,3-dimethyl-6-prop-2-enyl-7-pyrazolo[4,3-d]pyrimidinone IUPAC Name: 5-(3-chloro-4-fluoroanilino)-1,3-dimethyl-6-prop-2-enylpyrazolo[4,3-d]pyrimidin-7-one Traditional Name: 6-allyl-5-(3-chloro-4-fluoro-anilino)-1,3-dimethyl-pyrazolo[4,3-d]pyrimidin-7-one Formula: C16H15ClFN5O MolecularWeight: 347.774603

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1N=C(N(C2=O)CC=C)NC3=CC(=C(C=C3)F)Cl)C

Isomeric SMILES

CC1=NN(C2=C1N=C(N(C2=O)CC=C)NC3=CC(=C(C=C3)F)Cl)C

InChI

InChI=1S/C16H15ClFN5O/c1-4-7-23-15(24)14-13(9(2)21-22(14)3)20-16(23)19-10-5-6-12(18)11(17)8-10/h4-6,8H,1,7H2,2-3H3,(H,19,20)