6-[3-(azepan-1-yl)-3-oxidanylidene-propyl]-5,7-dimethyl-pyrazolo[1,5-a]pyrimidine-3-carbonitrile

Systemtic Name: 6-[3-(azepan-1-yl)-3-oxidanylidene-propyl]-5,7-dimethyl-pyrazolo[1,5-a]pyrimidine-3-carbonitrile Openeye Name: 6-[3-(azepan-1-yl)-3-oxo-propyl]-5,7-dimethyl-pyrazolo[1,5-a]pyrimidine-3-carbonitrile CAS Name: 6-[3-(1-azepanyl)-3-oxopropyl]-5,7-dimethyl-3-pyrazolo[1,5-a]pyrimidinecarbonitrile IUPAC Name: 6-[3-(azepan-1-yl)-3-oxopropyl]-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carbonitrile Traditional Name: 6-[3-(azepan-1-yl)-3-keto-propyl]-5,7-dimethyl-pyrazolo[1,5-a]pyrimidine-3-carbonitrile Formula: C18H23N5O MolecularWeight: 325.40812

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=C(C=NN12)C#N)C)CCC(=O)N3CCCCCC3

Isomeric SMILES

CC1=C(C(=NC2=C(C=NN12)C#N)C)CCC(=O)N3CCCCCC3

InChI

InChI=1S/C18H23N5O/c1-13-16(7-8-17(24)22-9-5-3-4-6-10-22)14(2)23-18(21-13)15(11-19)12-20-23/h12H,3-10H2,1-2H3