3-[4-(1,3-dimethyl-7-oxidanylidene-6-propyl-pyrazolo[4,3-d]pyrimidin-5-yl)piperazin-1-yl]carbonylbenzenecarbonitrile

Systemtic Name: 3-[4-(1,3-dimethyl-7-oxidanylidene-6-propyl-pyrazolo[4,3-d]pyrimidin-5-yl)piperazin-1-yl]carbonylbenzenecarbonitrile Openeye Name: 3-[4-(1,3-dimethyl-7-oxo-6-propyl-pyrazolo[4,3-d]pyrimidin-5-yl)piperazine-1-carbonyl]benzonitrile CAS Name: 3-[[4-(1,3-dimethyl-7-oxo-6-propyl-5-pyrazolo[4,3-d]pyrimidinyl)-1-piperazinyl]-oxomethyl]benzonitrile IUPAC Name: 3-[4-(1,3-dimethyl-7-oxo-6-propylpyrazolo[4,3-d]pyrimidin-5-yl)piperazine-1-carbonyl]benzonitrile Traditional Name: 3-[4-(7-keto-1,3-dimethyl-6-propyl-pyrazolo[4,3-d]pyrimidin-5-yl)piperazine-1-carbonyl]benzonitrile Formula: C22H25N7O2 MolecularWeight: 419.4796

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=C(C(=NN2C)C)N=C1N3CCN(CC3)C(=O)C4=CC=CC(=C4)C#N

Isomeric SMILES

CCCN1C(=O)C2=C(C(=NN2C)C)N=C1N3CCN(CC3)C(=O)C4=CC=CC(=C4)C#N

InChI

InChI=1S/C22H25N7O2/c1-4-8-29-21(31)19-18(15(2)25-26(19)3)24-22(29)28-11-9-27(10-12-28)20(30)17-7-5-6-16(13-17)14-23/h5-7,13H,4,8-12H2,1-3H3