N-[5-bromanyl-3-(2-imidazol-1-ylethoxy)pyrazin-2-yl]-3-chloranyl-6-sulfanylidene-cyclohexa-1,3-diene-1-sulfonamide

Systemtic Name: N-[5-bromanyl-3-(2-imidazol-1-ylethoxy)pyrazin-2-yl]-3-chloranyl-6-sulfanylidene-cyclohexa-1,3-diene-1-sulfonamide Openeye Name: N-[5-bromo-3-(2-imidazol-1-ylethoxy)pyrazin-2-yl]-3-chloro-6-thioxo-cyclohexa-1,3-diene-1-sulfonamide CAS Name: N-[5-bromo-3-[2-(1-imidazolyl)ethoxy]-2-pyrazinyl]-3-chloro-6-sulfanylidene-1-cyclohexa-1,3-dienesulfonamide IUPAC Name: N-[5-bromo-3-(2-imidazol-1-ylethoxy)pyrazin-2-yl]-3-chloro-6-sulfanylidenecyclohexa-1,3-diene-1-sulfonamide Traditional Name: N-[5-bromo-3-(2-imidazol-1-ylethoxy)pyrazin-2-yl]-3-chloro-6-thioxo-cyclohexa-1,3-diene-1-sulfonamide Formula: C15H13BrClN5O3S2 MolecularWeight: 490.78242

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Descriptors Computed from Structure

Canonical SMILES:

C1C=C(C=C(C1=S)S(=O)(=O)NC2=NC=C(N=C2OCCN3C=CN=C3)Br)Cl

Isomeric SMILES

C1C=C(C=C(C1=S)S(=O)(=O)NC2=NC=C(N=C2OCCN3C=CN=C3)Br)Cl

InChI

InChI=1S/C15H13BrClN5O3S2/c16-13-8-19-14(15(20-13)25-6-5-22-4-3-18-9-22)21-27(23,24)12-7-10(17)1-2-11(12)26/h1,3-4,7-9H,2,5-6H2,(H,19,21)