N4-(1,3-benzodioxol-5-yl)-6-(4-chloranyl-3,5-dimethyl-phenoxy)pyrimidine-4,5-diamine

Systemtic Name: N4-(1,3-benzodioxol-5-yl)-6-(4-chloranyl-3,5-dimethyl-phenoxy)pyrimidine-4,5-diamine Openeye Name: N4-(1,3-benzodioxol-5-yl)-6-(4-chloro-3,5-dimethyl-phenoxy)pyrimidine-4,5-diamine CAS Name: N4-(1,3-benzodioxol-5-yl)-6-(4-chloro-3,5-dimethylphenoxy)pyrimidine-4,5-diamine IUPAC Name: 4-N-(1,3-benzodioxol-5-yl)-6-(4-chloro-3,5-dimethylphenoxy)pyrimidine-4,5-diamine Traditional Name: [5-amino-6-(4-chloro-3,5-dimethyl-phenoxy)pyrimidin-4-yl]-(1,3-benzodioxol-5-yl)amine Formula: C19H17ClN4O3 MolecularWeight: 384.81628

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1Cl)C)OC2=NC=NC(=C2N)NC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=CC(=CC(=C1Cl)C)OC2=NC=NC(=C2N)NC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C19H17ClN4O3/c1-10-5-13(6-11(2)16(10)20)27-19-17(21)18(22-8-23-19)24-12-3-4-14-15(7-12)26-9-25-14/h3-8H,9,21H2,1-2H3,(H,22,23,24)