3-[2-(4-chlorophenyl)sulfonylethylsulfanyl]-5-(2-methylfuran-3-yl)-4-prop-2-enyl-1,2,4-triazole

Systemtic Name: 3-[2-(4-chlorophenyl)sulfonylethylsulfanyl]-5-(2-methylfuran-3-yl)-4-prop-2-enyl-1,2,4-triazole Openeye Name: 4-allyl-3-[2-(4-chlorophenyl)sulfonylethylsulfanyl]-5-(2-methyl-3-furyl)-1,2,4-triazole CAS Name: 3-[2-(4-chlorophenyl)sulfonylethylthio]-5-(2-methyl-3-furanyl)-4-prop-2-enyl-1,2,4-triazole IUPAC Name: 3-[2-(4-chlorophenyl)sulfonylethylsulfanyl]-5-(2-methylfuran-3-yl)-4-prop-2-enyl-1,2,4-triazole Traditional Name: 4-allyl-3-[2-(4-chlorophenyl)sulfonylethylthio]-5-(2-methyl-3-furyl)-1,2,4-triazole Formula: C18H18ClN3O3S2 MolecularWeight: 423.93682

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CO1)C2=NN=C(N2CC=C)SCCS(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=C(C=CO1)C2=NN=C(N2CC=C)SCCS(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H18ClN3O3S2/c1-3-9-22-17(16-8-10-25-13(16)2)20-21-18(22)26-11-12-27(23,24)15-6-4-14(19)5-7-15/h3-8,10H,1,9,11-12H2,2H3