N-[2-[(5-bromanyl-2-chloranyl-pyrimidin-4-yl)amino]ethyl]-5-nitro-thiophene-2-sulfonamide

Systemtic Name: N-[2-[(5-bromanyl-2-chloranyl-pyrimidin-4-yl)amino]ethyl]-5-nitro-thiophene-2-sulfonamide Openeye Name: N-[2-[(5-bromo-2-chloro-pyrimidin-4-yl)amino]ethyl]-5-nitro-thiophene-2-sulfonamide CAS Name: N-[2-[(5-bromo-2-chloro-4-pyrimidinyl)amino]ethyl]-5-nitro-2-thiophenesulfonamide IUPAC Name: N-[2-[(5-bromo-2-chloropyrimidin-4-yl)amino]ethyl]-5-nitrothiophene-2-sulfonamide Traditional Name: N-[2-[(5-bromo-2-chloro-pyrimidin-4-yl)amino]ethyl]-5-nitro-thiophene-2-sulfonamide Formula: C10H9BrClN5O4S2 MolecularWeight: 442.69656

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(SC(=C1)S(=O)(=O)NCCNC2=NC(=NC=C2Br)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=C(SC(=C1)S(=O)(=O)NCCNC2=NC(=NC=C2Br)Cl)[N+](=O)[O-]

InChI

InChI=1S/C10H9BrClN5O4S2/c11-6-5-14-10(12)16-9(6)13-3-4-15-23(20,21)8-2-1-7(22-8)17(18)19/h1-2,5,15H,3-4H2,(H,13,14,16)