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

Systemtic Name: N-(3,4-dimethylphenyl)-4-(4-pyrrolidin-1-ylsulfonylphenyl)-1,3-thiazol-2-amine hydrobromide Openeye Name: N-(3,4-dimethylphenyl)-4-(4-pyrrolidin-1-ylsulfonylphenyl)thiazol-2-amine hydrobromide CAS Name: N-(3,4-dimethylphenyl)-4-[4-(1-pyrrolidinylsulfonyl)phenyl]-2-thiazolamine hydrobromide IUPAC Name: N-(3,4-dimethylphenyl)-4-(4-pyrrolidin-1-ylsulfonylphenyl)-1,3-thiazol-2-amine hydrobromide Traditional Name: (3,4-dimethylphenyl)-[4-(4-pyrrolidinosulfonylphenyl)thiazol-2-yl]amine hydrobromide Formula: C21H24BrN3O2S2 MolecularWeight: 494.46816

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC2=NC(=CS2)C3=CC=C(C=C3)S(=O)(=O)N4CCCC4)C.Br

Isomeric SMILES

CC1=C(C=C(C=C1)NC2=NC(=CS2)C3=CC=C(C=C3)S(=O)(=O)N4CCCC4)C.Br

InChI

InChI=1S/C21H23N3O2S2.BrH/c1-15-5-8-18(13-16(15)2)22-21-23-20(14-27-21)17-6-9-19(10-7-17)28(25,26)24-11-3-4-12-24;/h5-10,13-14H,3-4,11-12H2,1-2H3,(H,22,23);1H