N-[3-(2-methylpyrimidin-4-yl)phenyl]-2,1,3-benzothiadiazole-4-sulfonamide

Systemtic Name: N-[3-(2-methylpyrimidin-4-yl)phenyl]-2,1,3-benzothiadiazole-4-sulfonamide Openeye Name: N-[3-(2-methylpyrimidin-4-yl)phenyl]-2,1,3-benzothiadiazole-4-sulfonamide CAS Name: N-[3-(2-methyl-4-pyrimidinyl)phenyl]-2,1,3-benzothiadiazole-4-sulfonamide IUPAC Name: N-[3-(2-methylpyrimidin-4-yl)phenyl]-2,1,3-benzothiadiazole-4-sulfonamide Traditional Name: N-[3-(2-methylpyrimidin-4-yl)phenyl]piazthiole-4-sulfonamide Formula: C17H13N5O2S2 MolecularWeight: 383.44742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=CC(=N1)C2=CC(=CC=C2)NS(=O)(=O)C3=CC=CC4=NSN=C43

Isomeric SMILES

CC1=NC=CC(=N1)C2=CC(=CC=C2)NS(=O)(=O)C3=CC=CC4=NSN=C43

InChI

InChI=1S/C17H13N5O2S2/c1-11-18-9-8-14(19-11)12-4-2-5-13(10-12)22-26(23,24)16-7-3-6-15-17(16)21-25-20-15/h2-10,22H,1H3