4-[[1-azanyl-5-(4-bromanyl-2-chloranyl-6-methyl-phenoxy)-1,3,5-triazinan-2-yl]amino]benzenecarbonitrile

Systemtic Name: 4-[[1-azanyl-5-(4-bromanyl-2-chloranyl-6-methyl-phenoxy)-1,3,5-triazinan-2-yl]amino]benzenecarbonitrile Openeye Name: 4-[[1-amino-5-(4-bromo-2-chloro-6-methyl-phenoxy)-1,3,5-triazinan-2-yl]amino]benzonitrile CAS Name: 4-[[1-amino-5-(4-bromo-2-chloro-6-methylphenoxy)-1,3,5-triazinan-2-yl]amino]benzonitrile IUPAC Name: 4-[[1-amino-5-(4-bromo-2-chloro-6-methylphenoxy)-1,3,5-triazinan-2-yl]amino]benzonitrile Traditional Name: 4-[[1-amino-5-(4-bromo-2-chloro-6-methyl-phenoxy)-1,3,5-triazinan-2-yl]amino]benzonitrile Formula: C17H18BrClN6O MolecularWeight: 437.72142

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1ON2CNC(N(C2)N)NC3=CC=C(C=C3)C#N)Cl)Br

Isomeric SMILES

CC1=CC(=CC(=C1ON2CNC(N(C2)N)NC3=CC=C(C=C3)C#N)Cl)Br

InChI

InChI=1S/C17H18BrClN6O/c1-11-6-13(18)7-15(19)16(11)26-24-9-22-17(25(21)10-24)23-14-4-2-12(8-20)3-5-14/h2-7,17,22-23H,9-10,21H2,1H3