2-chloranyl-5-(3-cyclopentylprop-1-ynyl)-N-phenyl-pyrimidin-4-amine

Systemtic Name: 2-chloranyl-5-(3-cyclopentylprop-1-ynyl)-N-phenyl-pyrimidin-4-amine Openeye Name: 2-chloro-5-(3-cyclopentylprop-1-ynyl)-N-phenyl-pyrimidin-4-amine CAS Name: 2-chloro-5-(3-cyclopentylprop-1-ynyl)-N-phenyl-4-pyrimidinamine IUPAC Name: 2-chloro-5-(3-cyclopentylprop-1-ynyl)-N-phenylpyrimidin-4-amine Traditional Name: [2-chloro-5-(3-cyclopentylprop-1-ynyl)pyrimidin-4-yl]-phenyl-amine Formula: C18H18ClN3 MolecularWeight: 311.80862

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)CC#CC2=CN=C(N=C2NC3=CC=CC=C3)Cl

Isomeric SMILES

C1CCC(C1)CC#CC2=CN=C(N=C2NC3=CC=CC=C3)Cl

InChI

InChI=1S/C18H18ClN3/c19-18-20-13-15(10-6-9-14-7-4-5-8-14)17(22-18)21-16-11-2-1-3-12-16/h1-3,11-14H,4-5,7-9H2,(H,20,21,22)