N-(1-methylpyrazol-3-yl)-3-(4-methylsulfanylphenyl)sulfanyl-6-(1H-1,2,4-triazol-5-ylsulfanyl)pyrazine-2-carboxamide

Systemtic Name: N-(1-methylpyrazol-3-yl)-3-(4-methylsulfanylphenyl)sulfanyl-6-(1H-1,2,4-triazol-5-ylsulfanyl)pyrazine-2-carboxamide Openeye Name: N-(1-methylpyrazol-3-yl)-3-(4-methylsulfanylphenyl)sulfanyl-6-(1H-1,2,4-triazol-5-ylsulfanyl)pyrazine-2-carboxamide CAS Name: N-(1-methyl-3-pyrazolyl)-3-[[4-(methylthio)phenyl]thio]-6-(1H-1,2,4-triazol-5-ylthio)-2-pyrazinecarboxamide IUPAC Name: N-(1-methylpyrazol-3-yl)-3-(4-methylsulfanylphenyl)sulfanyl-6-(1H-1,2,4-triazol-5-ylsulfanyl)pyrazine-2-carboxamide Traditional Name: N-(1-methylpyrazol-3-yl)-3-[[4-(methylthio)phenyl]thio]-6-(1H-1,2,4-triazol-5-ylthio)pyrazinamide Formula: C18H16N8OS3 MolecularWeight: 456.56764

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC(=N1)NC(=O)C2=NC(=CN=C2SC3=CC=C(C=C3)SC)SC4=NC=NN4

Isomeric SMILES

CN1C=CC(=N1)NC(=O)C2=NC(=CN=C2SC3=CC=C(C=C3)SC)SC4=NC=NN4

InChI

InChI=1S/C18H16N8OS3/c1-26-8-7-13(25-26)22-16(27)15-17(29-12-5-3-11(28-2)4-6-12)19-9-14(23-15)30-18-20-10-21-24-18/h3-10H,1-2H3,(H,20,21,24)(H,22,25,27)