1-ethanoyl-3-(3-methyl-1,4-diphenyl-pyrazolo[3,4-d]pyrimidin-6-yl)-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 1-ethanoyl-3-(3-methyl-1,4-diphenyl-pyrazolo[3,4-d]pyrimidin-6-yl)-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 1-acetyl-3-(3-methyl-1,4-diphenyl-pyrazolo[3,4-d]pyrimidin-6-yl)-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 1-acetyl-3-(3-methyl-1,4-diphenyl-6-pyrazolo[3,4-d]pyrimidinyl)-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 1-acetyl-3-(3-methyl-1,4-diphenylpyrazolo[3,4-d]pyrimidin-6-yl)-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 1-acetyl-3-(3-methyl-1,4-diphenyl-pyrazolo[3,4-d]pyrimidin-6-yl)-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C24H18N6O3S MolecularWeight: 470.50312

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=NC(=NC(=C12)C3=CC=CC=C3)N4C(=O)CC(=O)N(C4=S)C(=O)C)C5=CC=CC=C5

Isomeric SMILES

CC1=NN(C2=NC(=NC(=C12)C3=CC=CC=C3)N4C(=O)CC(=O)N(C4=S)C(=O)C)C5=CC=CC=C5

InChI

InChI=1S/C24H18N6O3S/c1-14-20-21(16-9-5-3-6-10-16)25-23(26-22(20)30(27-14)17-11-7-4-8-12-17)29-19(33)13-18(32)28(15(2)31)24(29)34/h3-12H,13H2,1-2H3