3-(3-morpholin-4-ylpropyl)-N-phenyl-4-(4-pyrrolidin-1-ylsulfonylphenyl)-1,3-thiazol-3-ium-2-amine

Systemtic Name: 3-(3-morpholin-4-ylpropyl)-N-phenyl-4-(4-pyrrolidin-1-ylsulfonylphenyl)-1,3-thiazol-3-ium-2-amine Openeye Name: 3-(3-morpholinopropyl)-N-phenyl-4-(4-pyrrolidin-1-ylsulfonylphenyl)thiazol-3-ium-2-amine CAS Name: 3-[3-(4-morpholinyl)propyl]-N-phenyl-4-[4-(1-pyrrolidinylsulfonyl)phenyl]-2-thiazol-3-iumamine IUPAC Name: 3-(3-morpholin-4-ylpropyl)-N-phenyl-4-(4-pyrrolidin-1-ylsulfonylphenyl)-1,3-thiazol-3-ium-2-amine Traditional Name: [3-(3-morpholinopropyl)-4-(4-pyrrolidinosulfonylphenyl)thiazol-3-ium-2-yl]-phenyl-amine Formula: C26H33N4O3S2+ MolecularWeight: 513.69522

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C3=CSC(=[N+]3CCCN4CCOCC4)NC5=CC=CC=C5

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C3=CSC(=[N+]3CCCN4CCOCC4)NC5=CC=CC=C5

InChI

InChI=1S/C26H32N4O3S2/c31-35(32,29-14-4-5-15-29)24-11-9-22(10-12-24)25-21-34-26(27-23-7-2-1-3-8-23)30(25)16-6-13-28-17-19-33-20-18-28/h1-3,7-12,21H,4-6,13-20H2/p+1