N-[(2-azanyl-4-methyl-pyrimidin-5-yl)methyl]-2-[3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-6-methyl-2-oxidanylidene-pyridin-1-yl]ethanamide

Systemtic Name: N-[(2-azanyl-4-methyl-pyrimidin-5-yl)methyl]-2-[3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-6-methyl-2-oxidanylidene-pyridin-1-yl]ethanamide Openeye Name: N-[(2-amino-4-methyl-pyrimidin-5-yl)methyl]-2-[3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-6-methyl-2-oxo-1-pyridyl]acetamide CAS Name: N-[(2-amino-4-methyl-5-pyrimidinyl)methyl]-2-[3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-6-methyl-2-oxo-1-pyridinyl]acetamide IUPAC Name: N-[(2-amino-4-methylpyrimidin-5-yl)methyl]-2-[3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-6-methyl-2-oxopyridin-1-yl]acetamide Traditional Name: N-[(2-amino-4-methyl-pyrimidin-5-yl)methyl]-2-[3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-2-keto-6-methyl-1-pyridyl]acetamide Formula: C22H24N6O6S MolecularWeight: 500.52756

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C(=O)N1CC(=O)NCC2=CN=C(N=C2C)N)NS(=O)(=O)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CC1=CC=C(C(=O)N1CC(=O)NCC2=CN=C(N=C2C)N)NS(=O)(=O)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C22H24N6O6S/c1-13-3-5-17(27-35(31,32)16-4-6-18-19(9-16)34-8-7-33-18)21(30)28(13)12-20(29)24-10-15-11-25-22(23)26-14(15)2/h3-6,9,11,27H,7-8,10,12H2,1-2H3,(H,24,29)(H2,23,25,26)