6-(2-chloranyl-4-methoxy-phenyl)-N4-heptan-4-yl-pyrimidine-4,5-diamine

Systemtic Name: 6-(2-chloranyl-4-methoxy-phenyl)-N4-heptan-4-yl-pyrimidine-4,5-diamine Openeye Name: 6-(2-chloro-4-methoxy-phenyl)-N4-(1-propylbutyl)pyrimidine-4,5-diamine CAS Name: 6-(2-chloro-4-methoxyphenyl)-N4-heptan-4-ylpyrimidine-4,5-diamine IUPAC Name: 6-(2-chloro-4-methoxyphenyl)-4-N-heptan-4-ylpyrimidine-4,5-diamine Traditional Name: [5-amino-6-(2-chloro-4-methoxy-phenyl)pyrimidin-4-yl]-(1-propylbutyl)amine Formula: C18H25ClN4O MolecularWeight: 348.8703

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)NC1=NC=NC(=C1N)C2=C(C=C(C=C2)OC)Cl

Isomeric SMILES

CCCC(CCC)NC1=NC=NC(=C1N)C2=C(C=C(C=C2)OC)Cl

InChI

InChI=1S/C18H25ClN4O/c1-4-6-12(7-5-2)23-18-16(20)17(21-11-22-18)14-9-8-13(24-3)10-15(14)19/h8-12H,4-7,20H2,1-3H3,(H,21,22,23)