N4-(5-chloranyl-1,3-benzodioxol-4-yl)-N2-(3-chloranyl-4-morpholin-4-yl-phenyl)pyrimidine-2,4-diamine

Systemtic Name: N4-(5-chloranyl-1,3-benzodioxol-4-yl)-N2-(3-chloranyl-4-morpholin-4-yl-phenyl)pyrimidine-2,4-diamine Openeye Name: N4-(5-chloro-1,3-benzodioxol-4-yl)-N2-(3-chloro-4-morpholino-phenyl)pyrimidine-2,4-diamine CAS Name: N4-(5-chloro-1,3-benzodioxol-4-yl)-N2-[3-chloro-4-(4-morpholinyl)phenyl]pyrimidine-2,4-diamine IUPAC Name: 4-N-(5-chloro-1,3-benzodioxol-4-yl)-2-N-(3-chloro-4-morpholin-4-ylphenyl)pyrimidine-2,4-diamine Traditional Name: (5-chloro-1,3-benzodioxol-4-yl)-[2-(3-chloro-4-morpholino-anilino)pyrimidin-4-yl]amine Formula: C21H19Cl2N5O3 MolecularWeight: 460.31326

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)NC3=NC=CC(=N3)NC4=C(C=CC5=C4OCO5)Cl)Cl

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)NC3=NC=CC(=N3)NC4=C(C=CC5=C4OCO5)Cl)Cl

InChI

InChI=1S/C21H19Cl2N5O3/c22-14-2-4-17-20(31-12-30-17)19(14)26-18-5-6-24-21(27-18)25-13-1-3-16(15(23)11-13)28-7-9-29-10-8-28/h1-6,11H,7-10,12H2,(H2,24,25,26,27)