N,N-diethyl-4-[3-[[(2R)-oxolan-2-yl]methyl]-2-phenylazanyl-1,3-thiazol-3-ium-4-yl]benzenesulfonamide

Systemtic Name: N,N-diethyl-4-[3-[[(2R)-oxolan-2-yl]methyl]-2-phenylazanyl-1,3-thiazol-3-ium-4-yl]benzenesulfonamide Openeye Name: 4-[2-anilino-3-[[(2R)-tetrahydrofuran-2-yl]methyl]thiazol-3-ium-4-yl]-N,N-diethyl-benzenesulfonamide CAS Name: 4-[2-anilino-3-[[(2R)-2-oxolanyl]methyl]-4-thiazol-3-iumyl]-N,N-diethylbenzenesulfonamide IUPAC Name: 4-[2-anilino-3-[[(2R)-oxolan-2-yl]methyl]-1,3-thiazol-3-ium-4-yl]-N,N-diethylbenzenesulfonamide Traditional Name: 4-[2-anilino-3-[[(2R)-tetrahydrofuran-2-yl]methyl]thiazol-3-ium-4-yl]-N,N-diethyl-benzenesulfonamide Formula: C24H30N3O3S2+ MolecularWeight: 472.6433

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)C2=CSC(=[N+]2CC3CCCO3)NC4=CC=CC=C4

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)C2=CSC(=[N+]2C[C@H]3CCCO3)NC4=CC=CC=C4

InChI

InChI=1S/C24H29N3O3S2/c1-3-26(4-2)32(28,29)22-14-12-19(13-15-22)23-18-31-24(25-20-9-6-5-7-10-20)27(23)17-21-11-8-16-30-21/h5-7,9-10,12-15,18,21H,3-4,8,11,16-17H2,1-2H3/p+1/t21-/m1/s1