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

Systemtic Name: 2-[(4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methylsulfanylmethyl]benzenecarbonitrile Openeye Name: 2-[(4-amino-6-anilino-1,3,5-triazin-2-yl)methylsulfanylmethyl]benzonitrile CAS Name: 2-[[(4-amino-6-anilino-1,3,5-triazin-2-yl)methylthio]methyl]benzonitrile IUPAC Name: 2-[(4-amino-6-anilino-1,3,5-triazin-2-yl)methylsulfanylmethyl]benzonitrile Traditional Name: 2-[[(4-amino-6-anilino-s-triazin-2-yl)methylthio]methyl]benzonitrile Formula: C18H16N6S MolecularWeight: 348.42484

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=NC(=NC(=N2)N)CSCC3=CC=CC=C3C#N

Isomeric SMILES

C1=CC=C(C=C1)NC2=NC(=NC(=N2)N)CSCC3=CC=CC=C3C#N

InChI

InChI=1S/C18H16N6S/c19-10-13-6-4-5-7-14(13)11-25-12-16-22-17(20)24-18(23-16)21-15-8-2-1-3-9-15/h1-9H,11-12H2,(H3,20,21,22,23,24)