N2-(1,3-benzodioxol-5-yl)-6-(5-chloranyl-2-methyl-phenyl)-1,3,5-triazine-2,4-diamine

Systemtic Name: N2-(1,3-benzodioxol-5-yl)-6-(5-chloranyl-2-methyl-phenyl)-1,3,5-triazine-2,4-diamine Openeye Name: N2-(1,3-benzodioxol-5-yl)-6-(5-chloro-2-methyl-phenyl)-1,3,5-triazine-2,4-diamine CAS Name: N2-(1,3-benzodioxol-5-yl)-6-(5-chloro-2-methylphenyl)-1,3,5-triazine-2,4-diamine IUPAC Name: 2-N-(1,3-benzodioxol-5-yl)-6-(5-chloro-2-methylphenyl)-1,3,5-triazine-2,4-diamine Traditional Name: [4-amino-6-(5-chloro-2-methyl-phenyl)-s-triazin-2-yl]-(1,3-benzodioxol-5-yl)amine Formula: C17H14ClN5O2 MolecularWeight: 355.77836

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)C2=NC(=NC(=N2)NC3=CC4=C(C=C3)OCO4)N

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)C2=NC(=NC(=N2)NC3=CC4=C(C=C3)OCO4)N

InChI

InChI=1S/C17H14ClN5O2/c1-9-2-3-10(18)6-12(9)15-21-16(19)23-17(22-15)20-11-4-5-13-14(7-11)25-8-24-13/h2-7H,8H2,1H3,(H3,19,20,21,22,23)