4-bromanyl-N-[3-(3-oxidanylpropyl)-2,4-dihydro-1H-1,3,5-triazin-6-yl]benzenesulfonamide

Systemtic Name: 4-bromanyl-N-[3-(3-oxidanylpropyl)-2,4-dihydro-1H-1,3,5-triazin-6-yl]benzenesulfonamide Openeye Name: 4-bromo-N-[3-(3-hydroxypropyl)-2,4-dihydro-1H-1,3,5-triazin-6-yl]benzenesulfonamide CAS Name: 4-bromo-N-[3-(3-hydroxypropyl)-2,4-dihydro-1H-1,3,5-triazin-6-yl]benzenesulfonamide IUPAC Name: 4-bromo-N-[3-(3-hydroxypropyl)-2,4-dihydro-1H-1,3,5-triazin-6-yl]benzenesulfonamide Traditional Name: 4-bromo-N-[3-(3-hydroxypropyl)-2,4-dihydro-1H-s-triazin-6-yl]benzenesulfonamide Formula: C12H17BrN4O3S MolecularWeight: 377.25738

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Descriptors Computed from Structure

Canonical SMILES:

C1NC(=NCN1CCCO)NS(=O)(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

C1NC(=NCN1CCCO)NS(=O)(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C12H17BrN4O3S/c13-10-2-4-11(5-3-10)21(19,20)16-12-14-8-17(9-15-12)6-1-7-18/h2-5,18H,1,6-9H2,(H2,14,15,16)