S-[3,6-bis(2-methylpropyl)pyrazin-2-yl] chloranylmethanethioate

Systemtic Name: S-[3,6-bis(2-methylpropyl)pyrazin-2-yl] chloranylmethanethioate Openeye Name: S-(3,6-diisobutylpyrazin-2-yl) chloromethanethioate CAS Name: chloromethanethioic acid S-[3,6-bis(2-methylpropyl)-2-pyrazinyl] ester IUPAC Name: S-[3,6-bis(2-methylpropyl)pyrazin-2-yl] chloromethanethioate Traditional Name: chloromethanethioic acid S-(3,6-diisobutylpyrazin-2-yl) ester Formula: C13H19ClN2OS MolecularWeight: 286.82076

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CN=C(C(=N1)SC(=O)Cl)CC(C)C

Isomeric SMILES

CC(C)CC1=CN=C(C(=N1)SC(=O)Cl)CC(C)C

InChI

InChI=1S/C13H19ClN2OS/c1-8(2)5-10-7-15-11(6-9(3)4)12(16-10)18-13(14)17/h7-9H,5-6H2,1-4H3