N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-[(4-imidazol-1-yl-6-methyl-pyrimidin-2-yl)amino]ethanamide

Systemtic Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-[(4-imidazol-1-yl-6-methyl-pyrimidin-2-yl)amino]ethanamide Openeye Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-[(4-imidazol-1-yl-6-methyl-pyrimidin-2-yl)amino]acetamide CAS Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-[[4-(1-imidazolyl)-6-methyl-2-pyrimidinyl]amino]acetamide IUPAC Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-[(4-imidazol-1-yl-6-methylpyrimidin-2-yl)amino]acetamide Traditional Name: N-homopiperonyl-2-[(4-imidazol-1-yl-6-methyl-pyrimidin-2-yl)amino]acetamide Formula: C19H20N6O3 MolecularWeight: 380.4005

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NCC(=O)NCCC2=CC3=C(C=C2)OCO3)N4C=CN=C4

Isomeric SMILES

CC1=CC(=NC(=N1)NCC(=O)NCCC2=CC3=C(C=C2)OCO3)N4C=CN=C4

InChI

InChI=1S/C19H20N6O3/c1-13-8-17(25-7-6-20-11-25)24-19(23-13)22-10-18(26)21-5-4-14-2-3-15-16(9-14)28-12-27-15/h2-3,6-9,11H,4-5,10,12H2,1H3,(H,21,26)(H,22,23,24)