4-(3-methoxypropyl)-3-[(4-phenylphenyl)methylsulfanyl]-1H-1,2,4-triazol-5-one

Systemtic Name: 4-(3-methoxypropyl)-3-[(4-phenylphenyl)methylsulfanyl]-1H-1,2,4-triazol-5-one Openeye Name: 4-(3-methoxypropyl)-3-[(4-phenylphenyl)methylsulfanyl]-1H-1,2,4-triazol-5-one CAS Name: 4-(3-methoxypropyl)-3-[(4-phenylphenyl)methylthio]-1H-1,2,4-triazol-5-one IUPAC Name: 4-(3-methoxypropyl)-3-[(4-phenylphenyl)methylsulfanyl]-1H-1,2,4-triazol-5-one Traditional Name: 4-(3-methoxypropyl)-3-[(4-phenylbenzyl)thio]-1H-1,2,4-triazol-5-one Formula: C19H21N3O2S MolecularWeight: 355.45394

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN1C(=O)NN=C1SCC2=CC=C(C=C2)C3=CC=CC=C3

Isomeric SMILES

COCCCN1C(=O)NN=C1SCC2=CC=C(C=C2)C3=CC=CC=C3

InChI

InChI=1S/C19H21N3O2S/c1-24-13-5-12-22-18(23)20-21-19(22)25-14-15-8-10-17(11-9-15)16-6-3-2-4-7-16/h2-4,6-11H,5,12-14H2,1H3,(H,20,23)