4-propyl-3-[(4-pyrazol-1-ylphenyl)methylsulfanyl]-1H-1,2,4-triazol-5-one

Systemtic Name: 4-propyl-3-[(4-pyrazol-1-ylphenyl)methylsulfanyl]-1H-1,2,4-triazol-5-one Openeye Name: 4-propyl-3-[(4-pyrazol-1-ylphenyl)methylsulfanyl]-1H-1,2,4-triazol-5-one CAS Name: 4-propyl-3-[[4-(1-pyrazolyl)phenyl]methylthio]-1H-1,2,4-triazol-5-one IUPAC Name: 4-propyl-3-[(4-pyrazol-1-ylphenyl)methylsulfanyl]-1H-1,2,4-triazol-5-one Traditional Name: 4-propyl-3-[(4-pyrazol-1-ylbenzyl)thio]-1H-1,2,4-triazol-5-one Formula: C15H17N5OS MolecularWeight: 315.39338

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)NN=C1SCC2=CC=C(C=C2)N3C=CC=N3

Isomeric SMILES

CCCN1C(=O)NN=C1SCC2=CC=C(C=C2)N3C=CC=N3

InChI

InChI=1S/C15H17N5OS/c1-2-9-19-14(21)17-18-15(19)22-11-12-4-6-13(7-5-12)20-10-3-8-16-20/h3-8,10H,2,9,11H2,1H3,(H,17,21)