N-(4-phenoxyphenyl)-4-(4-pyrrolidin-1-ylsulfonylphenyl)-1,3-thiazol-2-amine hydrobromide

Systemtic Name: N-(4-phenoxyphenyl)-4-(4-pyrrolidin-1-ylsulfonylphenyl)-1,3-thiazol-2-amine hydrobromide Openeye Name: N-(4-phenoxyphenyl)-4-(4-pyrrolidin-1-ylsulfonylphenyl)thiazol-2-amine hydrobromide CAS Name: N-(4-phenoxyphenyl)-4-[4-(1-pyrrolidinylsulfonyl)phenyl]-2-thiazolamine hydrobromide IUPAC Name: N-(4-phenoxyphenyl)-4-(4-pyrrolidin-1-ylsulfonylphenyl)-1,3-thiazol-2-amine hydrobromide Traditional Name: (4-phenoxyphenyl)-[4-(4-pyrrolidinosulfonylphenyl)thiazol-2-yl]amine hydrobromide Formula: C25H24BrN3O3S2 MolecularWeight: 558.51036

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C3=CSC(=N3)NC4=CC=C(C=C4)OC5=CC=CC=C5.Br

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C3=CSC(=N3)NC4=CC=C(C=C4)OC5=CC=CC=C5.Br

InChI

InChI=1S/C25H23N3O3S2.BrH/c29-33(30,28-16-4-5-17-28)23-14-8-19(9-15-23)24-18-32-25(27-24)26-20-10-12-22(13-11-20)31-21-6-2-1-3-7-21;/h1-3,6-15,18H,4-5,16-17H2,(H,26,27);1H