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

Systemtic Name: 4-[2-[1-(4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)ethylsulfanyl]ethoxy]benzenecarbonitrile Openeye Name: 4-[2-[1-(4-amino-6-anilino-1,3,5-triazin-2-yl)ethylsulfanyl]ethoxy]benzonitrile CAS Name: 4-[2-[1-(4-amino-6-anilino-1,3,5-triazin-2-yl)ethylthio]ethoxy]benzonitrile IUPAC Name: 4-[2-[1-(4-amino-6-anilino-1,3,5-triazin-2-yl)ethylsulfanyl]ethoxy]benzonitrile Traditional Name: 4-[2-[1-(4-amino-6-anilino-s-triazin-2-yl)ethylthio]ethoxy]benzonitrile Formula: C20H20N6OS MolecularWeight: 392.4774

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC(=NC(=N1)NC2=CC=CC=C2)N)SCCOC3=CC=C(C=C3)C#N

Isomeric SMILES

CC(C1=NC(=NC(=N1)NC2=CC=CC=C2)N)SCCOC3=CC=C(C=C3)C#N

InChI

InChI=1S/C20H20N6OS/c1-14(28-12-11-27-17-9-7-15(13-21)8-10-17)18-24-19(22)26-20(25-18)23-16-5-3-2-4-6-16/h2-10,14H,11-12H2,1H3,(H3,22,23,24,25,26)