N-[2-(1,3-benzodioxol-5-yl)ethyl]-4-(6-ethyl-2-imidazol-1-yl-4H-pyrimidin-3-yl)morpholine-3-carboxamide

Systemtic Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-4-(6-ethyl-2-imidazol-1-yl-4H-pyrimidin-3-yl)morpholine-3-carboxamide Openeye Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-4-(6-ethyl-2-imidazol-1-yl-4H-pyrimidin-3-yl)morpholine-3-carboxamide CAS Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-4-[6-ethyl-2-(1-imidazolyl)-4H-pyrimidin-3-yl]-3-morpholinecarboxamide IUPAC Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-4-(6-ethyl-2-imidazol-1-yl-4H-pyrimidin-3-yl)morpholine-3-carboxamide Traditional Name: 4-(6-ethyl-2-imidazol-1-yl-4H-pyrimidin-3-yl)-N-homopiperonyl-morpholine-3-carboxamide Formula: C23H28N6O4 MolecularWeight: 452.50622

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CCN(C(=N1)N2C=CN=C2)N3CCOCC3C(=O)NCCC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CCC1=CCN(C(=N1)N2C=CN=C2)N3CCOCC3C(=O)NCCC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C23H28N6O4/c1-2-18-6-9-29(23(26-18)27-10-8-24-15-27)28-11-12-31-14-19(28)22(30)25-7-5-17-3-4-20-21(13-17)33-16-32-20/h3-4,6,8,10,13,15,19H,2,5,7,9,11-12,14,16H2,1H3,(H,25,30)