3-[2-(3-methylphenoxy)ethylsulfanyl]-4-propyl-1H-1,2,4-triazol-5-one

Systemtic Name: 3-[2-(3-methylphenoxy)ethylsulfanyl]-4-propyl-1H-1,2,4-triazol-5-one Openeye Name: 3-[2-(3-methylphenoxy)ethylsulfanyl]-4-propyl-1H-1,2,4-triazol-5-one CAS Name: 3-[2-(3-methylphenoxy)ethylthio]-4-propyl-1H-1,2,4-triazol-5-one IUPAC Name: 3-[2-(3-methylphenoxy)ethylsulfanyl]-4-propyl-1H-1,2,4-triazol-5-one Traditional Name: 3-[2-(3-methylphenoxy)ethylthio]-4-propyl-1H-1,2,4-triazol-5-one Formula: C14H19N3O2S MolecularWeight: 293.38456

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)NN=C1SCCOC2=CC=CC(=C2)C

Isomeric SMILES

CCCN1C(=O)NN=C1SCCOC2=CC=CC(=C2)C

InChI

InChI=1S/C14H19N3O2S/c1-3-7-17-13(18)15-16-14(17)20-9-8-19-12-6-4-5-11(2)10-12/h4-6,10H,3,7-9H2,1-2H3,(H,15,18)