5-chloranyl-N-[1-(4-ethylsulfonylphenyl)propyl]-6-(1-fluoroethyl)pyrimidin-4-amine

Systemtic Name: 5-chloranyl-N-[1-(4-ethylsulfonylphenyl)propyl]-6-(1-fluoroethyl)pyrimidin-4-amine Openeye Name: 5-chloro-N-[1-(4-ethylsulfonylphenyl)propyl]-6-(1-fluoroethyl)pyrimidin-4-amine CAS Name: 5-chloro-N-[1-(4-ethylsulfonylphenyl)propyl]-6-(1-fluoroethyl)-4-pyrimidinamine IUPAC Name: 5-chloro-N-[1-(4-ethylsulfonylphenyl)propyl]-6-(1-fluoroethyl)pyrimidin-4-amine Traditional Name: [5-chloro-6-(1-fluoroethyl)pyrimidin-4-yl]-[1-(4-esylphenyl)propyl]amine Formula: C17H21ClFN3O2S MolecularWeight: 385.883943

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=C(C=C1)S(=O)(=O)CC)NC2=NC=NC(=C2Cl)C(C)F

Isomeric SMILES

CCC(C1=CC=C(C=C1)S(=O)(=O)CC)NC2=NC=NC(=C2Cl)C(C)F

InChI

InChI=1S/C17H21ClFN3O2S/c1-4-14(12-6-8-13(9-7-12)25(23,24)5-2)22-17-15(18)16(11(3)19)20-10-21-17/h6-11,14H,4-5H2,1-3H3,(H,20,21,22)