4-[[4-azanyl-6-(dimethylamino)-1,3,5-triazin-2-yl]methylsulfanylmethyl]benzenecarbonitrile

Systemtic Name: 4-[[4-azanyl-6-(dimethylamino)-1,3,5-triazin-2-yl]methylsulfanylmethyl]benzenecarbonitrile Openeye Name: 4-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]methylsulfanylmethyl]benzonitrile CAS Name: 4-[[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]methylthio]methyl]benzonitrile IUPAC Name: 4-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]methylsulfanylmethyl]benzonitrile Traditional Name: 4-[[[4-amino-6-(dimethylamino)-s-triazin-2-yl]methylthio]methyl]benzonitrile Formula: C14H16N6S MolecularWeight: 300.38204

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=NC(=NC(=N1)N)CSCC2=CC=C(C=C2)C#N

Isomeric SMILES

CN(C)C1=NC(=NC(=N1)N)CSCC2=CC=C(C=C2)C#N

InChI

InChI=1S/C14H16N6S/c1-20(2)14-18-12(17-13(16)19-14)9-21-8-11-5-3-10(7-15)4-6-11/h3-6H,8-9H2,1-2H3,(H2,16,17,18,19)