N2-(2-ethylphenyl)-6-[(4-propan-2-ylphenoxy)methyl]-1,3,5-triazine-2,4-diamine

Systemtic Name: N2-(2-ethylphenyl)-6-[(4-propan-2-ylphenoxy)methyl]-1,3,5-triazine-2,4-diamine Openeye Name: N2-(2-ethylphenyl)-6-[(4-isopropylphenoxy)methyl]-1,3,5-triazine-2,4-diamine CAS Name: N2-(2-ethylphenyl)-6-[(4-propan-2-ylphenoxy)methyl]-1,3,5-triazine-2,4-diamine IUPAC Name: 2-N-(2-ethylphenyl)-6-[(4-propan-2-ylphenoxy)methyl]-1,3,5-triazine-2,4-diamine Traditional Name: [4-amino-6-[(4-isopropylphenoxy)methyl]-s-triazin-2-yl]-(2-ethylphenyl)amine Formula: C21H25N5O MolecularWeight: 363.4561

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC2=NC(=NC(=N2)N)COC3=CC=C(C=C3)C(C)C

Isomeric SMILES

CCC1=CC=CC=C1NC2=NC(=NC(=N2)N)COC3=CC=C(C=C3)C(C)C

InChI

InChI=1S/C21H25N5O/c1-4-15-7-5-6-8-18(15)23-21-25-19(24-20(22)26-21)13-27-17-11-9-16(10-12-17)14(2)3/h5-12,14H,4,13H2,1-3H3,(H3,22,23,24,25,26)