6-[2-[4-(4-ethanoylphenyl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethyl]-5-methyl-7-oxidanylidene-1H-pyrazolo[1,5-a]pyrimidine-3-carbonitrile

Systemtic Name: 6-[2-[4-(4-ethanoylphenyl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethyl]-5-methyl-7-oxidanylidene-1H-pyrazolo[1,5-a]pyrimidine-3-carbonitrile Openeye Name: 6-[2-[4-(4-acetylphenyl)sulfonylpiperazin-1-yl]-2-oxo-ethyl]-5-methyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carbonitrile CAS Name: 6-[2-[4-(4-acetylphenyl)sulfonyl-1-piperazinyl]-2-oxoethyl]-5-methyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carbonitrile IUPAC Name: 6-[2-[4-(4-acetylphenyl)sulfonylpiperazin-1-yl]-2-oxoethyl]-5-methyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carbonitrile Traditional Name: 6-[2-[4-(4-acetylphenyl)sulfonylpiperazino]-2-keto-ethyl]-7-keto-5-methyl-1H-pyrazolo[1,5-a]pyrimidine-3-carbonitrile Formula: C22H22N6O5S MolecularWeight: 482.51228

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N2C(=N1)C(=CN2)C#N)CC(=O)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)C(=O)C

Isomeric SMILES

CC1=C(C(=O)N2C(=N1)C(=CN2)C#N)CC(=O)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)C(=O)C

InChI

InChI=1S/C22H22N6O5S/c1-14-19(22(31)28-21(25-14)17(12-23)13-24-28)11-20(30)26-7-9-27(10-8-26)34(32,33)18-5-3-16(4-6-18)15(2)29/h3-6,13,24H,7-11H2,1-2H3