1-[4-[3-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]-2-oxidanyl-propoxy]-3-methoxy-phenyl]ethanone

Systemtic Name: 1-[4-[3-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]-2-oxidanyl-propoxy]-3-methoxy-phenyl]ethanone Openeye Name: 1-[4-[3-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]-2-hydroxy-propoxy]-3-methoxy-phenyl]ethanone CAS Name: 1-[4-[3-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)thio]-2-hydroxypropoxy]-3-methoxyphenyl]ethanone IUPAC Name: 1-[4-[3-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]-2-hydroxypropoxy]-3-methoxyphenyl]ethanone Traditional Name: 1-[4-[3-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)thio]-2-hydroxy-propoxy]-3-methoxy-phenyl]ethanone Formula: C19H25N3O4S MolecularWeight: 391.4845

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(COC2=C(C=C(C=C2)C(=O)C)OC)O)C3CC3

Isomeric SMILES

CCN1C(=NN=C1SCC(COC2=C(C=C(C=C2)C(=O)C)OC)O)C3CC3

InChI

InChI=1S/C19H25N3O4S/c1-4-22-18(13-5-6-13)20-21-19(22)27-11-15(24)10-26-16-8-7-14(12(2)23)9-17(16)25-3/h7-9,13,15,24H,4-6,10-11H2,1-3H3