N-(4-cyano-5-methylsulfanyl-2-phenyl-pyrazol-3-yl)-3-oxidanylidene-4H-quinoxaline-2-carboxamide

Systemtic Name: N-(4-cyano-5-methylsulfanyl-2-phenyl-pyrazol-3-yl)-3-oxidanylidene-4H-quinoxaline-2-carboxamide Openeye Name: N-(4-cyano-5-methylsulfanyl-2-phenyl-pyrazol-3-yl)-3-oxo-4H-quinoxaline-2-carboxamide CAS Name: N-[4-cyano-5-(methylthio)-2-phenyl-3-pyrazolyl]-3-oxo-4H-quinoxaline-2-carboxamide IUPAC Name: N-(4-cyano-5-methylsulfanyl-2-phenylpyrazol-3-yl)-3-oxo-4H-quinoxaline-2-carboxamide Traditional Name: N-[4-cyano-5-(methylthio)-2-phenyl-pyrazol-3-yl]-3-keto-4H-quinoxaline-2-carboxamide Formula: C20H14N6O2S MolecularWeight: 402.42916

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NN(C(=C1C#N)NC(=O)C2=NC3=CC=CC=C3NC2=O)C4=CC=CC=C4

Isomeric SMILES

CSC1=NN(C(=C1C#N)NC(=O)C2=NC3=CC=CC=C3NC2=O)C4=CC=CC=C4

InChI

InChI=1S/C20H14N6O2S/c1-29-20-13(11-21)17(26(25-20)12-7-3-2-4-8-12)24-19(28)16-18(27)23-15-10-6-5-9-14(15)22-16/h2-10H,1H3,(H,23,27)(H,24,28)