4-ethyl-3-(3-methoxyphenyl)-5-[(E)-3-phenylprop-2-enyl]sulfanyl-1,2,4-triazole

Systemtic Name: 4-ethyl-3-(3-methoxyphenyl)-5-[(E)-3-phenylprop-2-enyl]sulfanyl-1,2,4-triazole Openeye Name: 3-[(E)-cinnamyl]sulfanyl-4-ethyl-5-(3-methoxyphenyl)-1,2,4-triazole CAS Name: 4-ethyl-3-(3-methoxyphenyl)-5-[[(E)-3-phenylprop-2-enyl]thio]-1,2,4-triazole IUPAC Name: 4-ethyl-3-(3-methoxyphenyl)-5-[(E)-3-phenylprop-2-enyl]sulfanyl-1,2,4-triazole Traditional Name: 3-[[(E)-cinnamyl]thio]-4-ethyl-5-(3-methoxyphenyl)-1,2,4-triazole Formula: C20H21N3OS MolecularWeight: 351.46524

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC=CC2=CC=CC=C2)C3=CC(=CC=C3)OC

Isomeric SMILES

CCN1C(=NN=C1SC/C=C/C2=CC=CC=C2)C3=CC(=CC=C3)OC

InChI

InChI=1S/C20H21N3OS/c1-3-23-19(17-12-7-13-18(15-17)24-2)21-22-20(23)25-14-8-11-16-9-5-4-6-10-16/h4-13,15H,3,14H2,1-2H3/b11-8+