6-[(5-azanyl-1H-1,2,4-triazol-3-yl)sulfanyl]-3-(4-methylsulfanylphenyl)sulfanyl-N-pyrazin-2-yl-pyrazine-2-carboxamide

Systemtic Name: 6-[(5-azanyl-1H-1,2,4-triazol-3-yl)sulfanyl]-3-(4-methylsulfanylphenyl)sulfanyl-N-pyrazin-2-yl-pyrazine-2-carboxamide Openeye Name: 6-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]-3-(4-methylsulfanylphenyl)sulfanyl-N-pyrazin-2-yl-pyrazine-2-carboxamide CAS Name: 6-[(5-amino-1H-1,2,4-triazol-3-yl)thio]-3-[[4-(methylthio)phenyl]thio]-N-(2-pyrazinyl)-2-pyrazinecarboxamide IUPAC Name: 6-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]-3-(4-methylsulfanylphenyl)sulfanyl-N-pyrazin-2-ylpyrazine-2-carboxamide Traditional Name: 6-[(5-amino-1H-1,2,4-triazol-3-yl)thio]-3-[[4-(methylthio)phenyl]thio]-N-pyrazin-2-yl-pyrazinamide Formula: C18H15N9OS3 MolecularWeight: 469.5664

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)SC2=NC=C(N=C2C(=O)NC3=NC=CN=C3)SC4=NNC(=N4)N

Isomeric SMILES

CSC1=CC=C(C=C1)SC2=NC=C(N=C2C(=O)NC3=NC=CN=C3)SC4=NNC(=N4)N

InChI

InChI=1S/C18H15N9OS3/c1-29-10-2-4-11(5-3-10)30-16-14(15(28)23-12-8-20-6-7-21-12)24-13(9-22-16)31-18-25-17(19)26-27-18/h2-9H,1H3,(H,21,23,28)(H3,19,25,26,27)