3-[2-methylsulfanyl-6-[(5-oxidanylidene-4-pentyl-1H-1,2,4-triazol-3-yl)sulfanyl]pyrimidin-4-yl]sulfanyl-4-pentyl-1H-1,2,4-triazol-5-one

Systemtic Name: 3-[2-methylsulfanyl-6-[(5-oxidanylidene-4-pentyl-1H-1,2,4-triazol-3-yl)sulfanyl]pyrimidin-4-yl]sulfanyl-4-pentyl-1H-1,2,4-triazol-5-one Openeye Name: 3-[2-methylsulfanyl-6-[(5-oxo-4-pentyl-1H-1,2,4-triazol-3-yl)sulfanyl]pyrimidin-4-yl]sulfanyl-4-pentyl-1H-1,2,4-triazol-5-one CAS Name: 3-[[2-(methylthio)-6-[(5-oxo-4-pentyl-1H-1,2,4-triazol-3-yl)thio]-4-pyrimidinyl]thio]-4-pentyl-1H-1,2,4-triazol-5-one IUPAC Name: 3-[2-methylsulfanyl-6-[(5-oxo-4-pentyl-1H-1,2,4-triazol-3-yl)sulfanyl]pyrimidin-4-yl]sulfanyl-4-pentyl-1H-1,2,4-triazol-5-one Traditional Name: 4-amyl-3-[[6-[(4-amyl-5-keto-1H-1,2,4-triazol-3-yl)thio]-2-(methylthio)pyrimidin-4-yl]thio]-1H-1,2,4-triazol-5-one Formula: C19H28N8O2S3 MolecularWeight: 496.67302

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)NN=C1SC2=CC(=NC(=N2)SC)SC3=NNC(=O)N3CCCCC

Isomeric SMILES

CCCCCN1C(=O)NN=C1SC2=CC(=NC(=N2)SC)SC3=NNC(=O)N3CCCCC

InChI

InChI=1S/C19H28N8O2S3/c1-4-6-8-10-26-16(28)22-24-18(26)31-13-12-14(21-15(20-13)30-3)32-19-25-23-17(29)27(19)11-9-7-5-2/h12H,4-11H2,1-3H3,(H,22,28)(H,23,29)