N4-(5-chloranyl-1,3-benzodioxol-4-yl)-N2-(1H-indazol-6-yl)pyrimidine-2,4-diamine

Systemtic Name: N4-(5-chloranyl-1,3-benzodioxol-4-yl)-N2-(1H-indazol-6-yl)pyrimidine-2,4-diamine Openeye Name: N4-(5-chloro-1,3-benzodioxol-4-yl)-N2-(1H-indazol-6-yl)pyrimidine-2,4-diamine CAS Name: N4-(5-chloro-1,3-benzodioxol-4-yl)-N2-(1H-indazol-6-yl)pyrimidine-2,4-diamine IUPAC Name: 4-N-(5-chloro-1,3-benzodioxol-4-yl)-2-N-(1H-indazol-6-yl)pyrimidine-2,4-diamine Traditional Name: (5-chloro-1,3-benzodioxol-4-yl)-[2-(1H-indazol-6-ylamino)pyrimidin-4-yl]amine Formula: C18H13ClN6O2 MolecularWeight: 380.78782

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C(=C(C=C2)Cl)NC3=NC(=NC=C3)NC4=CC5=C(C=C4)C=NN5

Isomeric SMILES

C1OC2=C(O1)C(=C(C=C2)Cl)NC3=NC(=NC=C3)NC4=CC5=C(C=C4)C=NN5

InChI

InChI=1S/C18H13ClN6O2/c19-12-3-4-14-17(27-9-26-14)16(12)23-15-5-6-20-18(24-15)22-11-2-1-10-8-21-25-13(10)7-11/h1-8H,9H2,(H,21,25)(H2,20,22,23,24)