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

Systemtic Name: 5-[(3-fluoranyl-4-methyl-phenyl)amino]-1,3-dimethyl-6-prop-2-enyl-pyrazolo[4,3-d]pyrimidin-7-one Openeye Name: 6-allyl-5-(3-fluoro-4-methyl-anilino)-1,3-dimethyl-pyrazolo[4,3-d]pyrimidin-7-one CAS Name: 5-(3-fluoro-4-methylanilino)-1,3-dimethyl-6-prop-2-enyl-7-pyrazolo[4,3-d]pyrimidinone IUPAC Name: 5-(3-fluoro-4-methylanilino)-1,3-dimethyl-6-prop-2-enylpyrazolo[4,3-d]pyrimidin-7-one Traditional Name: 6-allyl-5-(3-fluoro-4-methyl-anilino)-1,3-dimethyl-pyrazolo[4,3-d]pyrimidin-7-one Formula: C17H18FN5O MolecularWeight: 327.356123

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC2=NC3=C(C(=O)N2CC=C)N(N=C3C)C)F

Isomeric SMILES

CC1=C(C=C(C=C1)NC2=NC3=C(C(=O)N2CC=C)N(N=C3C)C)F

InChI

InChI=1S/C17H18FN5O/c1-5-8-23-16(24)15-14(11(3)21-22(15)4)20-17(23)19-12-7-6-10(2)13(18)9-12/h5-7,9H,1,8H2,2-4H3,(H,19,20)