N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-4-(5-methyl-1-propyl-pyrazol-4-yl)pyrimidin-2-amine

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-4-(5-methyl-1-propyl-pyrazol-4-yl)pyrimidin-2-amine Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-4-(5-methyl-1-propyl-pyrazol-4-yl)pyrimidin-2-amine CAS Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-4-(5-methyl-1-propyl-4-pyrazolyl)-2-pyrimidinamine IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-4-(5-methyl-1-propylpyrazol-4-yl)pyrimidin-2-amine Traditional Name: 2,3-dihydro-1,4-benzodioxin-3-ylmethyl-[4-(5-methyl-1-propyl-pyrazol-4-yl)pyrimidin-2-yl]amine Formula: C20H23N5O2 MolecularWeight: 365.42892

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C=N1)C2=NC(=NC=C2)NCC3COC4=CC=CC=C4O3)C

Isomeric SMILES

CCCN1C(=C(C=N1)C2=NC(=NC=C2)NCC3COC4=CC=CC=C4O3)C

InChI

InChI=1S/C20H23N5O2/c1-3-10-25-14(2)16(12-23-25)17-8-9-21-20(24-17)22-11-15-13-26-18-6-4-5-7-19(18)27-15/h4-9,12,15H,3,10-11,13H2,1-2H3,(H,21,22,24)