5-[(E)-2-(1,3-benzodioxol-5-yl)ethenyl]-3-methylsulfanyl-1,2-oxazole

Systemtic Name: 5-[(E)-2-(1,3-benzodioxol-5-yl)ethenyl]-3-methylsulfanyl-1,2-oxazole Openeye Name: 5-[(E)-2-(1,3-benzodioxol-5-yl)vinyl]-3-methylsulfanyl-isoxazole CAS Name: 5-[(E)-2-(1,3-benzodioxol-5-yl)ethenyl]-3-(methylthio)isoxazole IUPAC Name: 5-[(E)-2-(1,3-benzodioxol-5-yl)ethenyl]-3-methylsulfanyl-1,2-oxazole Traditional Name: 5-[(E)-2-(1,3-benzodioxol-5-yl)vinyl]-3-(methylthio)isoxazole Formula: C13H11NO3S MolecularWeight: 261.29634

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NOC(=C1)C=CC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CSC1=NOC(=C1)/C=C/C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C13H11NO3S/c1-18-13-7-10(17-14-13)4-2-9-3-5-11-12(6-9)16-8-15-11/h2-7H,8H2,1H3/b4-2+