3-acetamido-N-[2-[[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]amino]ethyl]-3-thiophen-2-yl-propanamide

Systemtic Name: 3-acetamido-N-[2-[[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]amino]ethyl]-3-thiophen-2-yl-propanamide Openeye Name: 3-acetamido-N-[2-[[3-chloro-5-(trifluoromethyl)-2-pyridyl]amino]ethyl]-3-(2-thienyl)propanamide CAS Name: 3-acetamido-N-[2-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]amino]ethyl]-3-thiophen-2-ylpropanamide IUPAC Name: 3-acetamido-N-[2-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino]ethyl]-3-thiophen-2-ylpropanamide Traditional Name: 3-acetamido-N-[2-[[3-chloro-5-(trifluoromethyl)-2-pyridyl]amino]ethyl]-3-(2-thienyl)propionamide Formula: C17H18ClF3N4O2S MolecularWeight: 434.86363

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC(=O)NCCNC1=C(C=C(C=N1)C(F)(F)F)Cl)C2=CC=CS2

Isomeric SMILES

CC(=O)NC(CC(=O)NCCNC1=C(C=C(C=N1)C(F)(F)F)Cl)C2=CC=CS2

InChI

InChI=1S/C17H18ClF3N4O2S/c1-10(26)25-13(14-3-2-6-28-14)8-15(27)22-4-5-23-16-12(18)7-11(9-24-16)17(19,20)21/h2-3,6-7,9,13H,4-5,8H2,1H3,(H,22,27)(H,23,24)(H,25,26)