4-[(2Z)-2-(5-azanylidene-6-cyano-7-methylsulfanyl-2-oxidanylidene-1H-pyrazolo[1,5-a]pyrimidin-3-ylidene)hydrazinyl]-N-pyrimidin-2-yl-benzenesulfonamide

Systemtic Name: 4-[(2Z)-2-(5-azanylidene-6-cyano-7-methylsulfanyl-2-oxidanylidene-1H-pyrazolo[1,5-a]pyrimidin-3-ylidene)hydrazinyl]-N-pyrimidin-2-yl-benzenesulfonamide Openeye Name: 4-[(2Z)-2-(6-cyano-5-imino-7-methylsulfanyl-2-oxo-1H-pyrazolo[1,5-a]pyrimidin-3-ylidene)hydrazino]-N-pyrimidin-2-yl-benzenesulfonamide CAS Name: 4-[(2Z)-2-[6-cyano-5-imino-7-(methylthio)-2-oxo-1H-pyrazolo[1,5-a]pyrimidin-3-ylidene]hydrazinyl]-N-(2-pyrimidinyl)benzenesulfonamide IUPAC Name: 4-[(2Z)-2-(6-cyano-5-imino-7-methylsulfanyl-2-oxo-1H-pyrazolo[1,5-a]pyrimidin-3-ylidene)hydrazinyl]-N-pyrimidin-2-ylbenzenesulfonamide Traditional Name: 4-[(N'Z)-N'-[6-cyano-5-imino-2-keto-7-(methylthio)-1H-pyrazolo[1,5-a]pyrimidin-3-ylidene]hydrazino]-N-(2-pyrimidyl)benzenesulfonamide Formula: C18H14N10O3S2 MolecularWeight: 482.49896

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C(=N)N=C2N1NC(=O)C2=NNC3=CC=C(C=C3)S(=O)(=O)NC4=NC=CC=N4)C#N

Isomeric SMILES

CSC1=C(C(=N)N=C\2N1NC(=O)/C2=N\NC3=CC=C(C=C3)S(=O)(=O)NC4=NC=CC=N4)C#N

InChI

InChI=1S/C18H14N10O3S2/c1-32-17-12(9-19)14(20)23-15-13(16(29)26-28(15)17)25-24-10-3-5-11(6-4-10)33(30,31)27-18-21-7-2-8-22-18/h2-8,20,24H,1H3,(H,26,29)(H,21,22,27)/b20-14?,25-13-