4-[[4-[(4-bromanyl-2,6-dimethyl-phenyl)amino]-1,3,5-triazin-2-yl]amino]benzenecarbonitrile

Systemtic Name: 4-[[4-[(4-bromanyl-2,6-dimethyl-phenyl)amino]-1,3,5-triazin-2-yl]amino]benzenecarbonitrile Openeye Name: 4-[[4-(4-bromo-2,6-dimethyl-anilino)-1,3,5-triazin-2-yl]amino]benzonitrile CAS Name: 4-[[4-(4-bromo-2,6-dimethylanilino)-1,3,5-triazin-2-yl]amino]benzonitrile IUPAC Name: 4-[[4-(4-bromo-2,6-dimethylanilino)-1,3,5-triazin-2-yl]amino]benzonitrile Traditional Name: 4-[[4-(4-bromo-2,6-dimethyl-anilino)-s-triazin-2-yl]amino]benzonitrile Formula: C18H15BrN6 MolecularWeight: 395.2559

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1NC2=NC=NC(=N2)NC3=CC=C(C=C3)C#N)C)Br

Isomeric SMILES

CC1=CC(=CC(=C1NC2=NC=NC(=N2)NC3=CC=C(C=C3)C#N)C)Br

InChI

InChI=1S/C18H15BrN6/c1-11-7-14(19)8-12(2)16(11)24-18-22-10-21-17(25-18)23-15-5-3-13(9-20)4-6-15/h3-8,10H,1-2H3,(H2,21,22,23,24,25)