3-methylsulfanyl-5-[4-(3-phenoxypropoxy)phenyl]-1,2-oxazole-4-carbonitrile

Systemtic Name: 3-methylsulfanyl-5-[4-(3-phenoxypropoxy)phenyl]-1,2-oxazole-4-carbonitrile Openeye Name: 3-methylsulfanyl-5-[4-(3-phenoxypropoxy)phenyl]isoxazole-4-carbonitrile CAS Name: 3-(methylthio)-5-[4-(3-phenoxypropoxy)phenyl]-4-isoxazolecarbonitrile IUPAC Name: 3-methylsulfanyl-5-[4-(3-phenoxypropoxy)phenyl]-1,2-oxazole-4-carbonitrile Traditional Name: 3-(methylthio)-5-[4-(3-phenoxypropoxy)phenyl]isoxazole-4-carbonitrile Formula: C20H18N2O3S MolecularWeight: 366.43352

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NOC(=C1C#N)C2=CC=C(C=C2)OCCCOC3=CC=CC=C3

Isomeric SMILES

CSC1=NOC(=C1C#N)C2=CC=C(C=C2)OCCCOC3=CC=CC=C3

InChI

InChI=1S/C20H18N2O3S/c1-26-20-18(14-21)19(25-22-20)15-8-10-17(11-9-15)24-13-5-12-23-16-6-3-2-4-7-16/h2-4,6-11H,5,12-13H2,1H3