4-cyclopropyl-3-(3-phenoxypropylsulfanyl)-1H-1,2,4-triazol-5-one

Systemtic Name: 4-cyclopropyl-3-(3-phenoxypropylsulfanyl)-1H-1,2,4-triazol-5-one Openeye Name: 4-cyclopropyl-3-(3-phenoxypropylsulfanyl)-1H-1,2,4-triazol-5-one CAS Name: 4-cyclopropyl-3-(3-phenoxypropylthio)-1H-1,2,4-triazol-5-one IUPAC Name: 4-cyclopropyl-3-(3-phenoxypropylsulfanyl)-1H-1,2,4-triazol-5-one Traditional Name: 4-cyclopropyl-3-(3-phenoxypropylthio)-1H-1,2,4-triazol-5-one Formula: C14H17N3O2S MolecularWeight: 291.36868

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=O)NN=C2SCCCOC3=CC=CC=C3

Isomeric SMILES

C1CC1N2C(=O)NN=C2SCCCOC3=CC=CC=C3

InChI

InChI=1S/C14H17N3O2S/c18-13-15-16-14(17(13)11-7-8-11)20-10-4-9-19-12-5-2-1-3-6-12/h1-3,5-6,11H,4,7-10H2,(H,15,18)