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

Systemtic Name: 5-[(4-azanyl-1,3,5-triazin-2-yl)sulfanyl]pentanenitrile Openeye Name: 5-[(4-amino-1,3,5-triazin-2-yl)sulfanyl]pentanenitrile CAS Name: 5-[(4-amino-1,3,5-triazin-2-yl)thio]pentanenitrile IUPAC Name: 5-[(4-amino-1,3,5-triazin-2-yl)sulfanyl]pentanenitrile Traditional Name: 5-[(4-amino-s-triazin-2-yl)thio]valeronitrile Formula: C8H11N5S MolecularWeight: 209.27144

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H11N5S/c9-4-2-1-3-5-14-8-12-6-11-7(10)13-8/h6H,1-3,5H2,(H2,10,11,12,13)