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

Systemtic Name: N-(4-ethoxyphenyl)-4-(4-pyrrolidin-1-ylsulfonylphenyl)-1,3-thiazol-2-amine hydrobromide Openeye Name: N-(4-ethoxyphenyl)-4-(4-pyrrolidin-1-ylsulfonylphenyl)thiazol-2-amine hydrobromide CAS Name: N-(4-ethoxyphenyl)-4-[4-(1-pyrrolidinylsulfonyl)phenyl]-2-thiazolamine hydrobromide IUPAC Name: N-(4-ethoxyphenyl)-4-(4-pyrrolidin-1-ylsulfonylphenyl)-1,3-thiazol-2-amine hydrobromide Traditional Name: p-phenetyl-[4-(4-pyrrolidinosulfonylphenyl)thiazol-2-yl]amine hydrobromide Formula: C21H24BrN3O3S2 MolecularWeight: 510.46756

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC2=NC(=CS2)C3=CC=C(C=C3)S(=O)(=O)N4CCCC4.Br

Isomeric SMILES

CCOC1=CC=C(C=C1)NC2=NC(=CS2)C3=CC=C(C=C3)S(=O)(=O)N4CCCC4.Br

InChI

InChI=1S/C21H23N3O3S2.BrH/c1-2-27-18-9-7-17(8-10-18)22-21-23-20(15-28-21)16-5-11-19(12-6-16)29(25,26)24-13-3-4-14-24;/h5-12,15H,2-4,13-14H2,1H3,(H,22,23);1H