5-[(1-cyclopropyl-5-phenyl-imidazol-2-yl)sulfanylmethyl]-7-oxidanylidene-1H-pyrazolo[1,5-a]pyrimidine-3-carbonitrile

Systemtic Name: 5-[(1-cyclopropyl-5-phenyl-imidazol-2-yl)sulfanylmethyl]-7-oxidanylidene-1H-pyrazolo[1,5-a]pyrimidine-3-carbonitrile Openeye Name: 5-[(1-cyclopropyl-5-phenyl-imidazol-2-yl)sulfanylmethyl]-7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carbonitrile CAS Name: 5-[[(1-cyclopropyl-5-phenyl-2-imidazolyl)thio]methyl]-7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carbonitrile IUPAC Name: 5-[(1-cyclopropyl-5-phenylimidazol-2-yl)sulfanylmethyl]-7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carbonitrile Traditional Name: 5-[[(1-cyclopropyl-5-phenyl-imidazol-2-yl)thio]methyl]-7-keto-1H-pyrazolo[1,5-a]pyrimidine-3-carbonitrile Formula: C20H16N6OS MolecularWeight: 388.44564

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=CN=C2SCC3=CC(=O)N4C(=N3)C(=CN4)C#N)C5=CC=CC=C5

Isomeric SMILES

C1CC1N2C(=CN=C2SCC3=CC(=O)N4C(=N3)C(=CN4)C#N)C5=CC=CC=C5

InChI

InChI=1S/C20H16N6OS/c21-9-14-10-23-26-18(27)8-15(24-19(14)26)12-28-20-22-11-17(25(20)16-6-7-16)13-4-2-1-3-5-13/h1-5,8,10-11,16,23H,6-7,12H2