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

Systemtic Name: 1,3-dimethyl-5-[[2-(phenylmethyl)phenyl]amino]-6-prop-2-enyl-pyrazolo[4,3-d]pyrimidin-7-one Openeye Name: 6-allyl-5-(2-benzylanilino)-1,3-dimethyl-pyrazolo[4,3-d]pyrimidin-7-one CAS Name: 1,3-dimethyl-5-[2-(phenylmethyl)anilino]-6-prop-2-enyl-7-pyrazolo[4,3-d]pyrimidinone IUPAC Name: 5-(2-benzylanilino)-1,3-dimethyl-6-prop-2-enylpyrazolo[4,3-d]pyrimidin-7-one Traditional Name: 6-allyl-5-(2-benzylanilino)-1,3-dimethyl-pyrazolo[4,3-d]pyrimidin-7-one Formula: C23H23N5O MolecularWeight: 385.46162

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1N=C(N(C2=O)CC=C)NC3=CC=CC=C3CC4=CC=CC=C4)C

Isomeric SMILES

CC1=NN(C2=C1N=C(N(C2=O)CC=C)NC3=CC=CC=C3CC4=CC=CC=C4)C

InChI

InChI=1S/C23H23N5O/c1-4-14-28-22(29)21-20(16(2)26-27(21)3)25-23(28)24-19-13-9-8-12-18(19)15-17-10-6-5-7-11-17/h4-13H,1,14-15H2,2-3H3,(H,24,25)