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

Systemtic Name: 1,3-dimethyl-5-[[(1S)-1-phenylethyl]amino]-6-prop-2-enyl-pyrazolo[4,3-d]pyrimidin-7-one Openeye Name: 6-allyl-1,3-dimethyl-5-[[(1S)-1-phenylethyl]amino]pyrazolo[4,3-d]pyrimidin-7-one CAS Name: 1,3-dimethyl-5-[[(1S)-1-phenylethyl]amino]-6-prop-2-enyl-7-pyrazolo[4,3-d]pyrimidinone IUPAC Name: 1,3-dimethyl-5-[[(1S)-1-phenylethyl]amino]-6-prop-2-enylpyrazolo[4,3-d]pyrimidin-7-one Traditional Name: 6-allyl-1,3-dimethyl-5-[[(1S)-1-phenylethyl]amino]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=NN(C2=C1N=C(N(C2=O)CC=C)NC(C)C3=CC=CC=C3)C

Isomeric SMILES

CC1=NN(C2=C1N=C(N(C2=O)CC=C)N[C@@H](C)C3=CC=CC=C3)C

InChI

InChI=1S/C18H21N5O/c1-5-11-23-17(24)16-15(13(3)21-22(16)4)20-18(23)19-12(2)14-9-7-6-8-10-14/h5-10,12H,1,11H2,2-4H3,(H,19,20)/t12-/m0/s1