N-[4-(2,4-dimethyl-1,3-thiazol-5-yl)pyrimidin-2-yl]-4-nitro-benzenesulfonamide

Systemtic Name: N-[4-(2,4-dimethyl-1,3-thiazol-5-yl)pyrimidin-2-yl]-4-nitro-benzenesulfonamide Openeye Name: N-[4-(2,4-dimethylthiazol-5-yl)pyrimidin-2-yl]-4-nitro-benzenesulfonamide CAS Name: N-[4-(2,4-dimethyl-5-thiazolyl)-2-pyrimidinyl]-4-nitrobenzenesulfonamide IUPAC Name: N-[4-(2,4-dimethyl-1,3-thiazol-5-yl)pyrimidin-2-yl]-4-nitrobenzenesulfonamide Traditional Name: N-[4-(2,4-dimethylthiazol-5-yl)pyrimidin-2-yl]-4-nitro-benzenesulfonamide Formula: C15H13N5O4S2 MolecularWeight: 391.42482

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)C)C2=NC(=NC=C2)NS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(SC(=N1)C)C2=NC(=NC=C2)NS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H13N5O4S2/c1-9-14(25-10(2)17-9)13-7-8-16-15(18-13)19-26(23,24)12-5-3-11(4-6-12)20(21)22/h3-8H,1-2H3,(H,16,18,19)