3-azanylsulfanyl-N-[2-[(5-bromanyl-2-chloranyl-pyrimidin-4-yl)amino]ethyl]cyclohexa-1,3-diene-1-sulfonamide

Systemtic Name: 3-azanylsulfanyl-N-[2-[(5-bromanyl-2-chloranyl-pyrimidin-4-yl)amino]ethyl]cyclohexa-1,3-diene-1-sulfonamide Openeye Name: 3-aminosulfanyl-N-[2-[(5-bromo-2-chloro-pyrimidin-4-yl)amino]ethyl]cyclohexa-1,3-diene-1-sulfonamide CAS Name: 3-(aminothio)-N-[2-[(5-bromo-2-chloro-4-pyrimidinyl)amino]ethyl]-1-cyclohexa-1,3-dienesulfonamide IUPAC Name: 3-aminosulfanyl-N-[2-[(5-bromo-2-chloropyrimidin-4-yl)amino]ethyl]cyclohexa-1,3-diene-1-sulfonamide Traditional Name: 3-(aminothio)-N-[2-[(5-bromo-2-chloro-pyrimidin-4-yl)amino]ethyl]cyclohexa-1,3-diene-1-sulfonamide Formula: C12H15BrClN5O2S2 MolecularWeight: 440.7668

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=CC(=C1)SN)S(=O)(=O)NCCNC2=NC(=NC=C2Br)Cl

Isomeric SMILES

C1CC(=CC(=C1)SN)S(=O)(=O)NCCNC2=NC(=NC=C2Br)Cl

InChI

InChI=1S/C12H15BrClN5O2S2/c13-10-7-17-12(14)19-11(10)16-4-5-18-23(20,21)9-3-1-2-8(6-9)22-15/h2,6-7,18H,1,3-5,15H2,(H,16,17,19)