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

Systemtic Name: 2-[[4,6-bis(phenylazanyl)-1,3,5-triazin-2-yl]sulfanylmethyl]benzenecarbonitrile Openeye Name: 2-[(4,6-dianilino-1,3,5-triazin-2-yl)sulfanylmethyl]benzonitrile CAS Name: 2-[[(4,6-dianilino-1,3,5-triazin-2-yl)thio]methyl]benzonitrile IUPAC Name: 2-[(4,6-dianilino-1,3,5-triazin-2-yl)sulfanylmethyl]benzonitrile Traditional Name: 2-[[(4,6-dianilino-s-triazin-2-yl)thio]methyl]benzonitrile Formula: C23H18N6S MolecularWeight: 410.49422

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=NC(=NC(=N2)SCC3=CC=CC=C3C#N)NC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)NC2=NC(=NC(=N2)SCC3=CC=CC=C3C#N)NC4=CC=CC=C4

InChI

InChI=1S/C23H18N6S/c24-15-17-9-7-8-10-18(17)16-30-23-28-21(25-19-11-3-1-4-12-19)27-22(29-23)26-20-13-5-2-6-14-20/h1-14H,16H2,(H2,25,26,27,28,29)