N-[3-[5-[2-(4-cyclohexylphenyl)-2-oxidanylidene-ethyl]sulfanyl-4-(2-fluorophenyl)-1,2,4-triazol-3-yl]propyl]ethanamide

Systemtic Name: N-[3-[5-[2-(4-cyclohexylphenyl)-2-oxidanylidene-ethyl]sulfanyl-4-(2-fluorophenyl)-1,2,4-triazol-3-yl]propyl]ethanamide Openeye Name: N-[3-[5-[2-(4-cyclohexylphenyl)-2-oxo-ethyl]sulfanyl-4-(2-fluorophenyl)-1,2,4-triazol-3-yl]propyl]acetamide CAS Name: N-[3-[5-[[2-(4-cyclohexylphenyl)-2-oxoethyl]thio]-4-(2-fluorophenyl)-1,2,4-triazol-3-yl]propyl]acetamide IUPAC Name: N-[3-[5-[2-(4-cyclohexylphenyl)-2-oxoethyl]sulfanyl-4-(2-fluorophenyl)-1,2,4-triazol-3-yl]propyl]acetamide Traditional Name: N-[3-[5-[[2-(4-cyclohexylphenyl)-2-keto-ethyl]thio]-4-(2-fluorophenyl)-1,2,4-triazol-3-yl]propyl]acetamide Formula: C27H31FN4O2S MolecularWeight: 494.624043

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCCC1=NN=C(N1C2=CC=CC=C2F)SCC(=O)C3=CC=C(C=C3)C4CCCCC4

Isomeric SMILES

CC(=O)NCCCC1=NN=C(N1C2=CC=CC=C2F)SCC(=O)C3=CC=C(C=C3)C4CCCCC4

InChI

InChI=1S/C27H31FN4O2S/c1-19(33)29-17-7-12-26-30-31-27(32(26)24-11-6-5-10-23(24)28)35-18-25(34)22-15-13-21(14-16-22)20-8-3-2-4-9-20/h5-6,10-11,13-16,20H,2-4,7-9,12,17-18H2,1H3,(H,29,33)