3-[3-(4-methoxyphenoxy)propylsulfanyl]-4-propyl-1H-1,2,4-triazol-5-one

Systemtic Name: 3-[3-(4-methoxyphenoxy)propylsulfanyl]-4-propyl-1H-1,2,4-triazol-5-one Openeye Name: 3-[3-(4-methoxyphenoxy)propylsulfanyl]-4-propyl-1H-1,2,4-triazol-5-one CAS Name: 3-[3-(4-methoxyphenoxy)propylthio]-4-propyl-1H-1,2,4-triazol-5-one IUPAC Name: 3-[3-(4-methoxyphenoxy)propylsulfanyl]-4-propyl-1H-1,2,4-triazol-5-one Traditional Name: 3-[3-(4-methoxyphenoxy)propylthio]-4-propyl-1H-1,2,4-triazol-5-one Formula: C15H21N3O3S MolecularWeight: 323.41054

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)NN=C1SCCCOC2=CC=C(C=C2)OC

Isomeric SMILES

CCCN1C(=O)NN=C1SCCCOC2=CC=C(C=C2)OC

InChI

InChI=1S/C15H21N3O3S/c1-3-9-18-14(19)16-17-15(18)22-11-4-10-21-13-7-5-12(20-2)6-8-13/h5-8H,3-4,9-11H2,1-2H3,(H,16,19)