5,6-Bis[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]pyrazine-2,3-dicarbonitrile
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Basic information
- Standard SMILES
Cc1nnc(Sc2nc(C#N)c(C#N)nc2Sc2nnc(C)s2)s1- InChIKey
YJJKFQITKJFDEH-UHFFFAOYSA-N- Molecular formula
- C12H6N8S4
- Average molar mass
- 390.5 g/mol
- Monoisotopic mass
- 389.95982692
Names & identifiers
- Preferred name
- 5,6-Bis[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]pyrazine-2,3-dicarbonitrile
- IUPAC
- 5,6-bis[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]pyrazine-2,3-dicarbonitrile
Names & synonyms
NSC7003615,6-bis[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]pyrazine-2,3-dicarbonitrileCHEMBL1965489NSC-700361NCI60_036025Pyrazine-2, 5,6-bis(5-methyl-1,3,4-thiadiazol-2-yl)-2,3-Pyrazinedicarbonitrile, 5,6-bis[(5-methyl-1,3,4-thiadiazol-2-yl)thio]-
Database identifiers
- PubChem CID
- 395616
- ChEMBL
CHEMBL1965489
Properties
Computed structural propertiesFilling in
- XLogP
- 3
- Topological polar surface area
- 232 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 12
- Rotatable bonds
- 4
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 498
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Compound notes
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