6-azanyl-5-[(6-azanyl-4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-5-yl)-[3-(4-nitrophenyl)-1-phenyl-pyrazol-4-yl]methyl]-2-sulfanylidene-1H-pyrimidin-4-one

Systemtic Name: 6-azanyl-5-[(6-azanyl-4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-5-yl)-[3-(4-nitrophenyl)-1-phenyl-pyrazol-4-yl]methyl]-2-sulfanylidene-1H-pyrimidin-4-one Openeye Name: 6-amino-5-[(6-amino-4-oxo-2-thioxo-1H-pyrimidin-5-yl)-[3-(4-nitrophenyl)-1-phenyl-pyrazol-4-yl]methyl]-2-thioxo-1H-pyrimidin-4-one CAS Name: 6-amino-5-[(6-amino-4-oxo-2-sulfanylidene-1H-pyrimidin-5-yl)-[3-(4-nitrophenyl)-1-phenyl-4-pyrazolyl]methyl]-2-sulfanylidene-1H-pyrimidin-4-one IUPAC Name: 6-amino-5-[(6-amino-4-oxo-2-sulfanylidene-1H-pyrimidin-5-yl)-[3-(4-nitrophenyl)-1-phenylpyrazol-4-yl]methyl]-2-sulfanylidene-1H-pyrimidin-4-one Traditional Name: 6-amino-5-[(6-amino-4-keto-2-thioxo-1H-pyrimidin-5-yl)-[3-(4-nitrophenyl)-1-phenyl-pyrazol-4-yl]methyl]-2-thioxo-1H-pyrimidin-4-one Formula: C24H19N9O4S2 MolecularWeight: 561.59556

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=C(C=C3)[N+](=O)[O-])C(C4=C(NC(=S)NC4=O)N)C5=C(NC(=S)NC5=O)N

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=C(C=C3)[N+](=O)[O-])C(C4=C(NC(=S)NC4=O)N)C5=C(NC(=S)NC5=O)N

InChI

InChI=1S/C24H19N9O4S2/c25-19-16(21(34)29-23(38)27-19)15(17-20(26)28-24(39)30-22(17)35)14-10-32(12-4-2-1-3-5-12)31-18(14)11-6-8-13(9-7-11)33(36)37/h1-10,15H,(H4,25,27,29,34,38)(H4,26,28,30,35,39)