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

Systemtic Name: 5-[(2,5-dimethylphenyl)amino]-1,3-dimethyl-6-prop-2-enyl-pyrazolo[4,3-d]pyrimidin-7-one Openeye Name: 6-allyl-5-(2,5-dimethylanilino)-1,3-dimethyl-pyrazolo[4,3-d]pyrimidin-7-one CAS Name: 5-(2,5-dimethylanilino)-1,3-dimethyl-6-prop-2-enyl-7-pyrazolo[4,3-d]pyrimidinone IUPAC Name: 5-(2,5-dimethylanilino)-1,3-dimethyl-6-prop-2-enylpyrazolo[4,3-d]pyrimidin-7-one Traditional Name: 6-allyl-5-(2,5-dimethylanilino)-1,3-dimethyl-pyrazolo[4,3-d]pyrimidin-7-one Formula: C18H21N5O MolecularWeight: 323.39224

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21N5O/c1-6-9-23-17(24)16-15(13(4)21-22(16)5)20-18(23)19-14-10-11(2)7-8-12(14)3/h6-8,10H,1,9H2,2-5H3,(H,19,20)