N-[3-(1,3-benzodioxol-5-ylmethoxy)phenyl]-4-(1,3-thiazol-2-yl)pyrimidin-2-amine

Systemtic Name: N-[3-(1,3-benzodioxol-5-ylmethoxy)phenyl]-4-(1,3-thiazol-2-yl)pyrimidin-2-amine Openeye Name: N-[3-(1,3-benzodioxol-5-ylmethoxy)phenyl]-4-thiazol-2-yl-pyrimidin-2-amine CAS Name: N-[3-(1,3-benzodioxol-5-ylmethoxy)phenyl]-4-(2-thiazolyl)-2-pyrimidinamine IUPAC Name: N-[3-(1,3-benzodioxol-5-ylmethoxy)phenyl]-4-(1,3-thiazol-2-yl)pyrimidin-2-amine Traditional Name: (3-piperonyloxyphenyl)-(4-thiazol-2-ylpyrimidin-2-yl)amine Formula: C21H16N4O3S MolecularWeight: 404.44174

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)COC3=CC=CC(=C3)NC4=NC=CC(=N4)C5=NC=CS5

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)COC3=CC=CC(=C3)NC4=NC=CC(=N4)C5=NC=CS5

InChI

InChI=1S/C21H16N4O3S/c1-2-15(24-21-23-7-6-17(25-21)20-22-8-9-29-20)11-16(3-1)26-12-14-4-5-18-19(10-14)28-13-27-18/h1-11H,12-13H2,(H,23,24,25)