4-[[3-(4-methoxyphenyl)-1,2-oxazol-5-yl]methylsulfanylmethyl]benzenecarbonitrile

Systemtic Name: 4-[[3-(4-methoxyphenyl)-1,2-oxazol-5-yl]methylsulfanylmethyl]benzenecarbonitrile Openeye Name: 4-[[3-(4-methoxyphenyl)isoxazol-5-yl]methylsulfanylmethyl]benzonitrile CAS Name: 4-[[[3-(4-methoxyphenyl)-5-isoxazolyl]methylthio]methyl]benzonitrile IUPAC Name: 4-[[3-(4-methoxyphenyl)-1,2-oxazol-5-yl]methylsulfanylmethyl]benzonitrile Traditional Name: 4-[[[3-(4-methoxyphenyl)isoxazol-5-yl]methylthio]methyl]benzonitrile Formula: C19H16N2O2S MolecularWeight: 336.40754

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NOC(=C2)CSCC3=CC=C(C=C3)C#N

Isomeric SMILES

COC1=CC=C(C=C1)C2=NOC(=C2)CSCC3=CC=C(C=C3)C#N

InChI

InChI=1S/C19H16N2O2S/c1-22-17-8-6-16(7-9-17)19-10-18(23-21-19)13-24-12-15-4-2-14(11-20)3-5-15/h2-10H,12-13H2,1H3