3-methyl-1-phenyl-5-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylmethyl]pyrazole-4-carbonitrile

Systemtic Name: 3-methyl-1-phenyl-5-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylmethyl]pyrazole-4-carbonitrile Openeye Name: 3-methyl-1-phenyl-5-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylmethyl]pyrazole-4-carbonitrile CAS Name: 3-methyl-1-phenyl-5-[[(1-phenyl-4-pyrazolo[3,4-d]pyrimidinyl)thio]methyl]-4-pyrazolecarbonitrile IUPAC Name: 3-methyl-1-phenyl-5-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylmethyl]pyrazole-4-carbonitrile Traditional Name: 3-methyl-1-phenyl-5-[[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)thio]methyl]pyrazole-4-carbonitrile Formula: C23H17N7S MolecularWeight: 423.49298

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C#N)CSC2=NC=NC3=C2C=NN3C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC1=NN(C(=C1C#N)CSC2=NC=NC3=C2C=NN3C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C23H17N7S/c1-16-19(12-24)21(29(28-16)17-8-4-2-5-9-17)14-31-23-20-13-27-30(22(20)25-15-26-23)18-10-6-3-7-11-18/h2-11,13,15H,14H2,1H3