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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H9BrClN5O4S2/c11-7-4-14-10(12)16-9(7)13-1-2-15-23(20,21)8-3-6(5-22-8)17(18)19/h3-5,15H,1-2H2,(H,13,14,16)