2-[[4,6-bis(ethylamino)-1,3,5-triazin-2-yl]sulfanyl]ethanenitrile

Systemtic Name: 2-[[4,6-bis(ethylamino)-1,3,5-triazin-2-yl]sulfanyl]ethanenitrile Openeye Name: 2-[[4,6-bis(ethylamino)-1,3,5-triazin-2-yl]sulfanyl]acetonitrile CAS Name: 2-[[4,6-bis(ethylamino)-1,3,5-triazin-2-yl]thio]acetonitrile IUPAC Name: 2-[[4,6-bis(ethylamino)-1,3,5-triazin-2-yl]sulfanyl]acetonitrile Traditional Name: 2-[[4,6-bis(ethylamino)-s-triazin-2-yl]thio]acetonitrile Formula: C9H14N6S MolecularWeight: 238.31266

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=NC(=NC(=N1)SCC#N)NCC

Isomeric SMILES

CCNC1=NC(=NC(=N1)SCC#N)NCC

InChI

InChI=1S/C9H14N6S/c1-3-11-7-13-8(12-4-2)15-9(14-7)16-6-5-10/h3-4,6H2,1-2H3,(H2,11,12,13,14,15)