N-[1-(4-butylsulfinylphenyl)ethyl]-5-chloranyl-6-(1-fluoroethyl)pyrimidin-4-amine

Systemtic Name: N-[1-(4-butylsulfinylphenyl)ethyl]-5-chloranyl-6-(1-fluoroethyl)pyrimidin-4-amine Openeye Name: N-[1-(4-butylsulfinylphenyl)ethyl]-5-chloro-6-(1-fluoroethyl)pyrimidin-4-amine CAS Name: N-[1-(4-butylsulfinylphenyl)ethyl]-5-chloro-6-(1-fluoroethyl)-4-pyrimidinamine IUPAC Name: N-[1-(4-butylsulfinylphenyl)ethyl]-5-chloro-6-(1-fluoroethyl)pyrimidin-4-amine Traditional Name: 1-(4-butylsulfinylphenyl)ethyl-[5-chloro-6-(1-fluoroethyl)pyrimidin-4-yl]amine Formula: C18H23ClFN3OS MolecularWeight: 383.911123

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)C1=CC=C(C=C1)C(C)NC2=NC=NC(=C2Cl)C(C)F

Isomeric SMILES

CCCCS(=O)C1=CC=C(C=C1)C(C)NC2=NC=NC(=C2Cl)C(C)F

InChI

InChI=1S/C18H23ClFN3OS/c1-4-5-10-25(24)15-8-6-14(7-9-15)13(3)23-18-16(19)17(12(2)20)21-11-22-18/h6-9,11-13H,4-5,10H2,1-3H3,(H,21,22,23)