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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N2C=CN=C2)CNC(=O)NCCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=CC(=NC(=N1)N2C=CN=C2)CNC(=O)NCCC3=CC4=C(C=C3)OCO4

InChI

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