(E)-3-(1,3-benzodioxol-5-yl)-2-(4,5-dimethyl-1,3-thiazol-2-yl)prop-2-enenitrile

Systemtic Name: (E)-3-(1,3-benzodioxol-5-yl)-2-(4,5-dimethyl-1,3-thiazol-2-yl)prop-2-enenitrile Openeye Name: (E)-3-(1,3-benzodioxol-5-yl)-2-(4,5-dimethylthiazol-2-yl)prop-2-enenitrile CAS Name: (E)-3-(1,3-benzodioxol-5-yl)-2-(4,5-dimethyl-2-thiazolyl)-2-propenenitrile IUPAC Name: (E)-3-(1,3-benzodioxol-5-yl)-2-(4,5-dimethyl-1,3-thiazol-2-yl)prop-2-enenitrile Traditional Name: (E)-3-(1,3-benzodioxol-5-yl)-2-(4,5-dimethylthiazol-2-yl)acrylonitrile Formula: C15H12N2O2S MolecularWeight: 284.33298

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)C(=CC2=CC3=C(C=C2)OCO3)C#N)C

Isomeric SMILES

CC1=C(SC(=N1)/C(=C/C2=CC3=C(C=C2)OCO3)/C#N)C

InChI

InChI=1S/C15H12N2O2S/c1-9-10(2)20-15(17-9)12(7-16)5-11-3-4-13-14(6-11)19-8-18-13/h3-6H,8H2,1-2H3/b12-5+