2-[[5-(furan-2-yl)-4-propyl-1,2,4-triazol-3-yl]sulfanyl]-1-(4-methoxyphenyl)ethanone

Systemtic Name: 2-[[5-(furan-2-yl)-4-propyl-1,2,4-triazol-3-yl]sulfanyl]-1-(4-methoxyphenyl)ethanone Openeye Name: 2-[[5-(2-furyl)-4-propyl-1,2,4-triazol-3-yl]sulfanyl]-1-(4-methoxyphenyl)ethanone CAS Name: 2-[[5-(2-furanyl)-4-propyl-1,2,4-triazol-3-yl]thio]-1-(4-methoxyphenyl)ethanone IUPAC Name: 2-[[5-(furan-2-yl)-4-propyl-1,2,4-triazol-3-yl]sulfanyl]-1-(4-methoxyphenyl)ethanone Traditional Name: 2-[[5-(2-furyl)-4-propyl-1,2,4-triazol-3-yl]thio]-1-(4-methoxyphenyl)ethanone Formula: C18H19N3O3S MolecularWeight: 357.42676

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=NN=C1SCC(=O)C2=CC=C(C=C2)OC)C3=CC=CO3

Isomeric SMILES

CCCN1C(=NN=C1SCC(=O)C2=CC=C(C=C2)OC)C3=CC=CO3

InChI

InChI=1S/C18H19N3O3S/c1-3-10-21-17(16-5-4-11-24-16)19-20-18(21)25-12-15(22)13-6-8-14(23-2)9-7-13/h4-9,11H,3,10,12H2,1-2H3