N-(3-ethylphenyl)-4-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)pyrimidin-2-amine

Systemtic Name: N-(3-ethylphenyl)-4-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)pyrimidin-2-amine Openeye Name: N-(3-ethylphenyl)-4-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)pyrimidin-2-amine CAS Name: N-(3-ethylphenyl)-4-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)-2-pyrimidinamine IUPAC Name: N-(3-ethylphenyl)-4-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)pyrimidin-2-amine Traditional Name: (3-ethylphenyl)-[4-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)pyrimidin-2-yl]amine Formula: C21H21N3O3 MolecularWeight: 363.40974

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)NC2=NC=CC(=N2)C3=CC4=C(C(=C3)OC)OCCO4

Isomeric SMILES

CCC1=CC(=CC=C1)NC2=NC=CC(=N2)C3=CC4=C(C(=C3)OC)OCCO4

InChI

InChI=1S/C21H21N3O3/c1-3-14-5-4-6-16(11-14)23-21-22-8-7-17(24-21)15-12-18(25-2)20-19(13-15)26-9-10-27-20/h4-8,11-13H,3,9-10H2,1-2H3,(H,22,23,24)