3-[(2-chloranylphenoxy)methyl]-4-cyclopropyl-5-[(E)-3-phenylprop-2-enyl]sulfanyl-1,2,4-triazole

Systemtic Name: 3-[(2-chloranylphenoxy)methyl]-4-cyclopropyl-5-[(E)-3-phenylprop-2-enyl]sulfanyl-1,2,4-triazole Openeye Name: 3-[(2-chlorophenoxy)methyl]-5-[(E)-cinnamyl]sulfanyl-4-cyclopropyl-1,2,4-triazole CAS Name: 3-[(2-chlorophenoxy)methyl]-4-cyclopropyl-5-[[(E)-3-phenylprop-2-enyl]thio]-1,2,4-triazole IUPAC Name: 3-[(2-chlorophenoxy)methyl]-4-cyclopropyl-5-[(E)-3-phenylprop-2-enyl]sulfanyl-1,2,4-triazole Traditional Name: 3-[(2-chlorophenoxy)methyl]-5-[[(E)-cinnamyl]thio]-4-cyclopropyl-1,2,4-triazole Formula: C21H20ClN3OS MolecularWeight: 397.921

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=NN=C2SCC=CC3=CC=CC=C3)COC4=CC=CC=C4Cl

Isomeric SMILES

C1CC1N2C(=NN=C2SC/C=C/C3=CC=CC=C3)COC4=CC=CC=C4Cl

InChI

InChI=1S/C21H20ClN3OS/c22-18-10-4-5-11-19(18)26-15-20-23-24-21(25(20)17-12-13-17)27-14-6-9-16-7-2-1-3-8-16/h1-11,17H,12-15H2/b9-6+