1-(3,4-dihydro-1,2-benzoxathiin-8-ylsulfonyl)-3-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)urea

Systemtic Name: 1-(3,4-dihydro-1,2-benzoxathiin-8-ylsulfonyl)-3-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)urea Openeye Name: 1-(3,4-dihydro-1,2-benzoxathiin-8-ylsulfonyl)-3-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)urea CAS Name: 1-(3,4-dihydro-1,2-benzoxathiin-8-ylsulfonyl)-3-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)urea IUPAC Name: 1-(3,4-dihydro-1,2-benzoxathiin-8-ylsulfonyl)-3-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)urea Traditional Name: 1-(3,4-dihydro-1,2-benzoxathiin-8-ylsulfonyl)-3-(4-methoxy-6-methyl-s-triazin-2-yl)urea Formula: C14H15N5O5S2 MolecularWeight: 397.4294

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC3=C2OSCC3

Isomeric SMILES

CC1=NC(=NC(=N1)OC)NC(=O)NS(=O)(=O)C2=CC=CC3=C2OSCC3

InChI

InChI=1S/C14H15N5O5S2/c1-8-15-12(18-14(16-8)23-2)17-13(20)19-26(21,22)10-5-3-4-9-6-7-25-24-11(9)10/h3-5H,6-7H2,1-2H3,(H2,15,16,17,18,19,20)