N-[3-(methylaminomethyl)phenyl]-2,4-bis(oxidanylidene)-1H-pyrimidine-5-sulfonamide

Systemtic Name: N-[3-(methylaminomethyl)phenyl]-2,4-bis(oxidanylidene)-1H-pyrimidine-5-sulfonamide Openeye Name: N-[3-(methylaminomethyl)phenyl]-2,4-dioxo-1H-pyrimidine-5-sulfonamide CAS Name: N-[3-(methylaminomethyl)phenyl]-2,4-dioxo-1H-pyrimidine-5-sulfonamide IUPAC Name: N-[3-(methylaminomethyl)phenyl]-2,4-dioxo-1H-pyrimidine-5-sulfonamide Traditional Name: 2,4-diketo-N-[3-(methylaminomethyl)phenyl]-1H-pyrimidine-5-sulfonamide Formula: C12H14N4O4S MolecularWeight: 310.32896

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Descriptors Computed from Structure

Canonical SMILES:

CNCC1=CC(=CC=C1)NS(=O)(=O)C2=CNC(=O)NC2=O

Isomeric SMILES

CNCC1=CC(=CC=C1)NS(=O)(=O)C2=CNC(=O)NC2=O

InChI

InChI=1S/C12H14N4O4S/c1-13-6-8-3-2-4-9(5-8)16-21(19,20)10-7-14-12(18)15-11(10)17/h2-5,7,13,16H,6H2,1H3,(H2,14,15,17,18)