5-chloranyl-6-ethyl-N-[1-[4-(3-methylbutoxy)phenyl]propyl]pyrimidin-4-amine

Systemtic Name: 5-chloranyl-6-ethyl-N-[1-[4-(3-methylbutoxy)phenyl]propyl]pyrimidin-4-amine Openeye Name: 5-chloro-6-ethyl-N-[1-(4-isopentyloxyphenyl)propyl]pyrimidin-4-amine CAS Name: 5-chloro-6-ethyl-N-[1-[4-(3-methylbutoxy)phenyl]propyl]-4-pyrimidinamine IUPAC Name: 5-chloro-6-ethyl-N-[1-[4-(3-methylbutoxy)phenyl]propyl]pyrimidin-4-amine Traditional Name: (5-chloro-6-ethyl-pyrimidin-4-yl)-[1-(4-isoamoxyphenyl)propyl]amine Formula: C20H28ClN3O MolecularWeight: 361.90882

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NC=N1)NC(CC)C2=CC=C(C=C2)OCCC(C)C)Cl

Isomeric SMILES

CCC1=C(C(=NC=N1)NC(CC)C2=CC=C(C=C2)OCCC(C)C)Cl

InChI

InChI=1S/C20H28ClN3O/c1-5-17(24-20-19(21)18(6-2)22-13-23-20)15-7-9-16(10-8-15)25-12-11-14(3)4/h7-10,13-14,17H,5-6,11-12H2,1-4H3,(H,22,23,24)