(E)-3-(7-bromanyl-1,3-benzodioxol-5-yl)-2-(4-phenyl-1,3-thiazol-2-yl)prop-2-enenitrile

Systemtic Name: (E)-3-(7-bromanyl-1,3-benzodioxol-5-yl)-2-(4-phenyl-1,3-thiazol-2-yl)prop-2-enenitrile Openeye Name: (E)-3-(7-bromo-1,3-benzodioxol-5-yl)-2-(4-phenylthiazol-2-yl)prop-2-enenitrile CAS Name: (E)-3-(7-bromo-1,3-benzodioxol-5-yl)-2-(4-phenyl-2-thiazolyl)-2-propenenitrile IUPAC Name: (E)-3-(7-bromo-1,3-benzodioxol-5-yl)-2-(4-phenyl-1,3-thiazol-2-yl)prop-2-enenitrile Traditional Name: (E)-3-(7-bromo-1,3-benzodioxol-5-yl)-2-(4-phenylthiazol-2-yl)acrylonitrile Formula: C19H11BrN2O2S MolecularWeight: 411.27184

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C(=CC(=C2)C=C(C#N)C3=NC(=CS3)C4=CC=CC=C4)Br

Isomeric SMILES

C1OC2=C(O1)C(=CC(=C2)/C=C(\C#N)/C3=NC(=CS3)C4=CC=CC=C4)Br

InChI

InChI=1S/C19H11BrN2O2S/c20-15-7-12(8-17-18(15)24-11-23-17)6-14(9-21)19-22-16(10-25-19)13-4-2-1-3-5-13/h1-8,10H,11H2/b14-6+