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

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

Systemtic Name:4-[3-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]-2-oxidanyl-propoxy]benzenecarbonitrile
Openeye Name:4-[3-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]-2-hydroxy-propoxy]benzonitrile
CAS Name:4-[3-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)thio]-2-hydroxypropoxy]benzonitrile
IUPAC Name:4-[3-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]-2-hydroxypropoxy]benzonitrile
Traditional Name:4-[3-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)thio]-2-hydroxy-propoxy]benzonitrile
Formula: C17H20N4O2S
MolecularWeight: 344.4313
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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(COC2=CC=C(C=C2)C#N)O)C3CC3


Isomeric SMILES

CCN1C(=NN=C1SCC(COC2=CC=C(C=C2)C#N)O)C3CC3


InChI

InChI=1S/C17H20N4O2S/c1-2-21-16(13-5-6-13)19-20-17(21)24-11-14(22)10-23-15-7-3-12(9-18)4-8-15/h3-4,7-8,13-14,22H,2,5-6,10-11H2,1H3


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