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

Systemtic Name: 4-(3-methoxypropyl)-3-[2-oxidanylidene-2-(4-phenylphenyl)ethyl]sulfanyl-1H-1,2,4-triazol-5-one Openeye Name: 4-(3-methoxypropyl)-3-[2-oxo-2-(4-phenylphenyl)ethyl]sulfanyl-1H-1,2,4-triazol-5-one CAS Name: 4-(3-methoxypropyl)-3-[[2-oxo-2-(4-phenylphenyl)ethyl]thio]-1H-1,2,4-triazol-5-one IUPAC Name: 4-(3-methoxypropyl)-3-[2-oxo-2-(4-phenylphenyl)ethyl]sulfanyl-1H-1,2,4-triazol-5-one Traditional Name: 3-[[2-keto-2-(4-phenylphenyl)ethyl]thio]-4-(3-methoxypropyl)-1H-1,2,4-triazol-5-one Formula: C20H21N3O3S MolecularWeight: 383.46404

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN1C(=O)NN=C1SCC(=O)C2=CC=C(C=C2)C3=CC=CC=C3

Isomeric SMILES

COCCCN1C(=O)NN=C1SCC(=O)C2=CC=C(C=C2)C3=CC=CC=C3

InChI

InChI=1S/C20H21N3O3S/c1-26-13-5-12-23-19(25)21-22-20(23)27-14-18(24)17-10-8-16(9-11-17)15-6-3-2-4-7-15/h2-4,6-11H,5,12-14H2,1H3,(H,21,25)