N-(4-ethanoylphenyl)-2-[[5-(2-methylfuran-3-yl)-4-propan-2-yl-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-(4-ethanoylphenyl)-2-[[5-(2-methylfuran-3-yl)-4-propan-2-yl-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: N-(4-acetylphenyl)-2-[[4-isopropyl-5-(2-methyl-3-furyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-(4-acetylphenyl)-2-[[5-(2-methyl-3-furanyl)-4-propan-2-yl-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-(4-acetylphenyl)-2-[[5-(2-methylfuran-3-yl)-4-propan-2-yl-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-(4-acetylphenyl)-2-[[4-isopropyl-5-(2-methyl-3-furyl)-1,2,4-triazol-3-yl]thio]acetamide Formula: C20H22N4O3S MolecularWeight: 398.47868

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CO1)C2=NN=C(N2C(C)C)SCC(=O)NC3=CC=C(C=C3)C(=O)C

Isomeric SMILES

CC1=C(C=CO1)C2=NN=C(N2C(C)C)SCC(=O)NC3=CC=C(C=C3)C(=O)C

InChI

InChI=1S/C20H22N4O3S/c1-12(2)24-19(17-9-10-27-14(17)4)22-23-20(24)28-11-18(26)21-16-7-5-15(6-8-16)13(3)25/h5-10,12H,11H2,1-4H3,(H,21,26)