(E)-3-[3-ethoxy-4-(2-oxidanylidene-2-piperidin-1-yl-ethoxy)phenyl]-2-(4-methyl-1,3-thiazol-2-yl)prop-2-enenitrile

Systemtic Name: (E)-3-[3-ethoxy-4-(2-oxidanylidene-2-piperidin-1-yl-ethoxy)phenyl]-2-(4-methyl-1,3-thiazol-2-yl)prop-2-enenitrile Openeye Name: (E)-3-[3-ethoxy-4-[2-oxo-2-(1-piperidyl)ethoxy]phenyl]-2-(4-methylthiazol-2-yl)prop-2-enenitrile CAS Name: (E)-3-[3-ethoxy-4-[2-oxo-2-(1-piperidinyl)ethoxy]phenyl]-2-(4-methyl-2-thiazolyl)-2-propenenitrile IUPAC Name: (E)-3-[3-ethoxy-4-(2-oxo-2-piperidin-1-ylethoxy)phenyl]-2-(4-methyl-1,3-thiazol-2-yl)prop-2-enenitrile Traditional Name: (E)-3-[3-ethoxy-4-(2-keto-2-piperidino-ethoxy)phenyl]-2-(4-methylthiazol-2-yl)acrylonitrile Formula: C22H25N3O3S MolecularWeight: 411.5172

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=C(C#N)C2=NC(=CS2)C)OCC(=O)N3CCCCC3

Isomeric SMILES

CCOC1=C(C=CC(=C1)/C=C(\C#N)/C2=NC(=CS2)C)OCC(=O)N3CCCCC3

InChI

InChI=1S/C22H25N3O3S/c1-3-27-20-12-17(11-18(13-23)22-24-16(2)15-29-22)7-8-19(20)28-14-21(26)25-9-5-4-6-10-25/h7-8,11-12,15H,3-6,9-10,14H2,1-2H3/b18-11+