3,3,3-tris(fluoranyl)propyl 3-methyl-1-phenyl-thieno[2,3-c]pyrazole-5-carboxylate

Systemtic Name: 3,3,3-tris(fluoranyl)propyl 3-methyl-1-phenyl-thieno[2,3-c]pyrazole-5-carboxylate Openeye Name: 3,3,3-trifluoropropyl 3-methyl-1-phenyl-thieno[2,3-c]pyrazole-5-carboxylate CAS Name: 3-methyl-1-phenyl-5-thieno[2,3-c]pyrazolecarboxylic acid 3,3,3-trifluoropropyl ester IUPAC Name: 3,3,3-trifluoropropyl 3-methyl-1-phenylthieno[2,3-c]pyrazole-5-carboxylate Traditional Name: 3-methyl-1-phenyl-thieno[2,3-c]pyrazole-5-carboxylic acid 3,3,3-trifluoropropyl ester Formula: C16H13F3N2O2S MolecularWeight: 354.34683

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C=C(S2)C(=O)OCCC(F)(F)F)C3=CC=CC=C3

Isomeric SMILES

CC1=NN(C2=C1C=C(S2)C(=O)OCCC(F)(F)F)C3=CC=CC=C3

InChI

InChI=1S/C16H13F3N2O2S/c1-10-12-9-13(15(22)23-8-7-16(17,18)19)24-14(12)21(20-10)11-5-3-2-4-6-11/h2-6,9H,7-8H2,1H3