3-[3-[2-(4-fluorophenyl)-2-oxidanylidene-ethyl]sulfanyl-5-thiophen-2-yl-1,2,4-triazol-4-yl]propanamide

Systemtic Name: 3-[3-[2-(4-fluorophenyl)-2-oxidanylidene-ethyl]sulfanyl-5-thiophen-2-yl-1,2,4-triazol-4-yl]propanamide Openeye Name: 3-[3-[2-(4-fluorophenyl)-2-oxo-ethyl]sulfanyl-5-(2-thienyl)-1,2,4-triazol-4-yl]propanamide CAS Name: 3-[3-[[2-(4-fluorophenyl)-2-oxoethyl]thio]-5-thiophen-2-yl-1,2,4-triazol-4-yl]propanamide IUPAC Name: 3-[3-[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl-5-thiophen-2-yl-1,2,4-triazol-4-yl]propanamide Traditional Name: 3-[3-[[2-(4-fluorophenyl)-2-keto-ethyl]thio]-5-(2-thienyl)-1,2,4-triazol-4-yl]propionamide Formula: C17H15FN4O2S2 MolecularWeight: 390.455003

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C2=NN=C(N2CCC(=O)N)SCC(=O)C3=CC=C(C=C3)F

Isomeric SMILES

C1=CSC(=C1)C2=NN=C(N2CCC(=O)N)SCC(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C17H15FN4O2S2/c18-12-5-3-11(4-6-12)13(23)10-26-17-21-20-16(14-2-1-9-25-14)22(17)8-7-15(19)24/h1-6,9H,7-8,10H2,(H2,19,24)