2-[(4-azanyl-1,3,5-triazin-2-yl)sulfanyl]ethanenitrile

Systemtic Name: 2-[(4-azanyl-1,3,5-triazin-2-yl)sulfanyl]ethanenitrile Openeye Name: 2-[(4-amino-1,3,5-triazin-2-yl)sulfanyl]acetonitrile CAS Name: 2-[(4-amino-1,3,5-triazin-2-yl)thio]acetonitrile IUPAC Name: 2-[(4-amino-1,3,5-triazin-2-yl)sulfanyl]acetonitrile Traditional Name: 2-[(4-amino-s-triazin-2-yl)thio]acetonitrile Formula: C5H5N5S MolecularWeight: 167.1917

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC(=NC(=N1)SCC#N)N

Isomeric SMILES

C1=NC(=NC(=N1)SCC#N)N

InChI

InChI=1S/C5H5N5S/c6-1-2-11-5-9-3-8-4(7)10-5/h3H,2H2,(H2,7,8,9,10)