2-(1,3-benzodioxol-5-yl)-N-[(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)methylsulfamoyl]ethanamine

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-N-[(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)methylsulfamoyl]ethanamine Openeye Name: 2-(1,3-benzodioxol-5-yl)-N-[(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)methylsulfamoyl]ethanamine CAS Name: 2-(1,3-benzodioxol-5-yl)-N-[[2-(1-imidazolyl)-6-methyl-4-pyrimidinyl]methylsulfamoyl]ethanamine IUPAC Name: 2-(1,3-benzodioxol-5-yl)-N-[(2-imidazol-1-yl-6-methylpyrimidin-4-yl)methylsulfamoyl]ethanamine Traditional Name: homopiperonyl-[(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)methylsulfamoyl]amine Formula: C18H20N6O4S MolecularWeight: 416.4542

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20N6O4S/c1-13-8-15(23-18(22-13)24-7-6-19-11-24)10-21-29(25,26)20-5-4-14-2-3-16-17(9-14)28-12-27-16/h2-3,6-9,11,20-21H,4-5,10,12H2,1H3