N-(1,3-benzodioxol-5-ylmethyl)-2-[(2-methoxyphenyl)methylamino]-4-methyl-pyrimidine-5-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(2-methoxyphenyl)methylamino]-4-methyl-pyrimidine-5-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(2-methoxyphenyl)methylamino]-4-methyl-pyrimidine-5-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(2-methoxyphenyl)methylamino]-4-methyl-5-pyrimidinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(2-methoxyphenyl)methylamino]-4-methylpyrimidine-5-carboxamide Traditional Name: 4-methyl-2-(o-anisylamino)-N-piperonyl-pyrimidine-5-carboxamide Formula: C22H22N4O4 MolecularWeight: 406.43448

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1C(=O)NCC2=CC3=C(C=C2)OCO3)NCC4=CC=CC=C4OC

Isomeric SMILES

CC1=NC(=NC=C1C(=O)NCC2=CC3=C(C=C2)OCO3)NCC4=CC=CC=C4OC

InChI

InChI=1S/C22H22N4O4/c1-14-17(21(27)23-10-15-7-8-19-20(9-15)30-13-29-19)12-25-22(26-14)24-11-16-5-3-4-6-18(16)28-2/h3-9,12H,10-11,13H2,1-2H3,(H,23,27)(H,24,25,26)