3-(2-phenoxyethylsulfanyl)-5-(3-propan-2-yloxyphenyl)-4-propyl-1,2,4-triazole

Systemtic Name: 3-(2-phenoxyethylsulfanyl)-5-(3-propan-2-yloxyphenyl)-4-propyl-1,2,4-triazole Openeye Name: 3-(3-isopropoxyphenyl)-5-(2-phenoxyethylsulfanyl)-4-propyl-1,2,4-triazole CAS Name: 3-(2-phenoxyethylthio)-5-(3-propan-2-yloxyphenyl)-4-propyl-1,2,4-triazole IUPAC Name: 3-(2-phenoxyethylsulfanyl)-5-(3-propan-2-yloxyphenyl)-4-propyl-1,2,4-triazole Traditional Name: 3-(3-isopropoxyphenyl)-5-(2-phenoxyethylthio)-4-propyl-1,2,4-triazole Formula: C22H27N3O2S MolecularWeight: 397.53368

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=NN=C1SCCOC2=CC=CC=C2)C3=CC(=CC=C3)OC(C)C

Isomeric SMILES

CCCN1C(=NN=C1SCCOC2=CC=CC=C2)C3=CC(=CC=C3)OC(C)C

InChI

InChI=1S/C22H27N3O2S/c1-4-13-25-21(18-9-8-12-20(16-18)27-17(2)3)23-24-22(25)28-15-14-26-19-10-6-5-7-11-19/h5-12,16-17H,4,13-15H2,1-3H3