3-chloranyl-N-[3-(phenylmethyl)sulfonylpropyl]-5-(trifluoromethyl)pyridin-2-amine

Systemtic Name: 3-chloranyl-N-[3-(phenylmethyl)sulfonylpropyl]-5-(trifluoromethyl)pyridin-2-amine Openeye Name: N-(3-benzylsulfonylpropyl)-3-chloro-5-(trifluoromethyl)pyridin-2-amine CAS Name: 3-chloro-N-[3-(phenylmethyl)sulfonylpropyl]-5-(trifluoromethyl)-2-pyridinamine IUPAC Name: N-(3-benzylsulfonylpropyl)-3-chloro-5-(trifluoromethyl)pyridin-2-amine Traditional Name: 3-benzylsulfonylpropyl-[3-chloro-5-(trifluoromethyl)-2-pyridyl]amine Formula: C16H16ClF3N2O2S MolecularWeight: 392.82365

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CS(=O)(=O)CCCNC2=C(C=C(C=N2)C(F)(F)F)Cl

Isomeric SMILES

C1=CC=C(C=C1)CS(=O)(=O)CCCNC2=C(C=C(C=N2)C(F)(F)F)Cl

InChI

InChI=1S/C16H16ClF3N2O2S/c17-14-9-13(16(18,19)20)10-22-15(14)21-7-4-8-25(23,24)11-12-5-2-1-3-6-12/h1-3,5-6,9-10H,4,7-8,11H2,(H,21,22)