6-chloranyl-N2,N4-bis(2,3-dihydro-1,4-benzodioxin-6-yl)pyrimidine-2,4-diamine

Systemtic Name: 6-chloranyl-N2,N4-bis(2,3-dihydro-1,4-benzodioxin-6-yl)pyrimidine-2,4-diamine Openeye Name: 6-chloro-N2,N4-bis(2,3-dihydro-1,4-benzodioxin-6-yl)pyrimidine-2,4-diamine CAS Name: 6-chloro-N2,N4-bis(2,3-dihydro-1,4-benzodioxin-6-yl)pyrimidine-2,4-diamine IUPAC Name: 6-chloro-2-N,4-N-bis(2,3-dihydro-1,4-benzodioxin-6-yl)pyrimidine-2,4-diamine Traditional Name: [4-chloro-6-(2,3-dihydro-1,4-benzodioxin-6-ylamino)pyrimidin-2-yl]-(2,3-dihydro-1,4-benzodioxin-6-yl)amine Formula: C20H17ClN4O4 MolecularWeight: 412.82638

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)NC3=CC(=NC(=N3)NC4=CC5=C(C=C4)OCCO5)Cl

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)NC3=CC(=NC(=N3)NC4=CC5=C(C=C4)OCCO5)Cl

InChI

InChI=1S/C20H17ClN4O4/c21-18-11-19(22-12-1-3-14-16(9-12)28-7-5-26-14)25-20(24-18)23-13-2-4-15-17(10-13)29-8-6-27-15/h1-4,9-11H,5-8H2,(H2,22,23,24,25)