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

Systemtic Name: 5-(azepan-1-yl)-1,3-dimethyl-6-prop-2-enyl-pyrazolo[4,3-d]pyrimidin-7-one Openeye Name: 6-allyl-5-(azepan-1-yl)-1,3-dimethyl-pyrazolo[4,3-d]pyrimidin-7-one CAS Name: 5-(1-azepanyl)-1,3-dimethyl-6-prop-2-enyl-7-pyrazolo[4,3-d]pyrimidinone IUPAC Name: 5-(azepan-1-yl)-1,3-dimethyl-6-prop-2-enylpyrazolo[4,3-d]pyrimidin-7-one Traditional Name: 6-allyl-5-(azepan-1-yl)-1,3-dimethyl-pyrazolo[4,3-d]pyrimidin-7-one Formula: C16H23N5O MolecularWeight: 301.38672

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1N=C(N(C2=O)CC=C)N3CCCCCC3)C

Isomeric SMILES

CC1=NN(C2=C1N=C(N(C2=O)CC=C)N3CCCCCC3)C

InChI

InChI=1S/C16H23N5O/c1-4-9-21-15(22)14-13(12(2)18-19(14)3)17-16(21)20-10-7-5-6-8-11-20/h4H,1,5-11H2,2-3H3