2-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-5-phenyl-7-thiophen-2-yl-1,7-dihydropyrazolo[1,5-a]pyrimidine-6-carbonitrile

Systemtic Name: 2-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-5-phenyl-7-thiophen-2-yl-1,7-dihydropyrazolo[1,5-a]pyrimidine-6-carbonitrile Openeye Name: 2-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-5-phenyl-7-(2-thienyl)-1,7-dihydropyrazolo[1,5-a]pyrimidine-6-carbonitrile CAS Name: 2-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-5-phenyl-7-thiophen-2-yl-1,7-dihydropyrazolo[1,5-a]pyrimidine-6-carbonitrile IUPAC Name: 2-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-5-phenyl-7-thiophen-2-yl-1,7-dihydropyrazolo[1,5-a]pyrimidine-6-carbonitrile Traditional Name: 2-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)-5-phenyl-7-(2-thienyl)-1,7-dihydropyrazolo[1,5-a]pyrimidine-6-carbonitrile Formula: C28H22N6OS MolecularWeight: 490.57888

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)C3=CC4=NC(=C(C(N4N3)C5=CC=CS5)C#N)C6=CC=CC=C6

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)C3=CC4=NC(=C(C(N4N3)C5=CC=CS5)C#N)C6=CC=CC=C6

InChI

InChI=1S/C28H22N6OS/c1-18-25(28(35)34(32(18)2)20-12-7-4-8-13-20)22-16-24-30-26(19-10-5-3-6-11-19)21(17-29)27(33(24)31-22)23-14-9-15-36-23/h3-16,27,31H,1-2H3