N-butan-2-yl-2-[[4-(4-fluorophenyl)-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-thiazole-4-carboxamide

Systemtic Name: N-butan-2-yl-2-[[4-(4-fluorophenyl)-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-thiazole-4-carboxamide Openeye Name: 2-[[4-(4-fluorophenyl)-5-(2-furyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-N-sec-butyl-thiazole-4-carboxamide CAS Name: N-butan-2-yl-2-[[[4-(4-fluorophenyl)-5-(2-furanyl)-1,2,4-triazol-3-yl]thio]methyl]-4-thiazolecarboxamide IUPAC Name: N-butan-2-yl-2-[[4-(4-fluorophenyl)-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-thiazole-4-carboxamide Traditional Name: 2-[[[4-(4-fluorophenyl)-5-(2-furyl)-1,2,4-triazol-3-yl]thio]methyl]-N-sec-butyl-thiazole-4-carboxamide Formula: C21H20FN5O2S2 MolecularWeight: 457.544203

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=CSC(=N1)CSC2=NN=C(N2C3=CC=C(C=C3)F)C4=CC=CO4

Isomeric SMILES

CCC(C)NC(=O)C1=CSC(=N1)CSC2=NN=C(N2C3=CC=C(C=C3)F)C4=CC=CO4

InChI

InChI=1S/C21H20FN5O2S2/c1-3-13(2)23-20(28)16-11-30-18(24-16)12-31-21-26-25-19(17-5-4-10-29-17)27(21)15-8-6-14(22)7-9-15/h4-11,13H,3,12H2,1-2H3,(H,23,28)