3-(2-morpholin-4-ylethyl)-N-phenyl-4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-3-ium-2-amine

Systemtic Name: 3-(2-morpholin-4-ylethyl)-N-phenyl-4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-3-ium-2-amine Openeye Name: 3-(2-morpholinoethyl)-N-phenyl-4-[4-(1-piperidylsulfonyl)phenyl]thiazol-3-ium-2-amine CAS Name: 3-[2-(4-morpholinyl)ethyl]-N-phenyl-4-[4-(1-piperidinylsulfonyl)phenyl]-2-thiazol-3-iumamine IUPAC Name: 3-(2-morpholin-4-ylethyl)-N-phenyl-4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-3-ium-2-amine Traditional Name: [3-(2-morpholinoethyl)-4-(4-piperidinosulfonylphenyl)thiazol-3-ium-2-yl]-phenyl-amine Formula: C26H33N4O3S2+ MolecularWeight: 513.69522

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C3=CSC(=[N+]3CCN4CCOCC4)NC5=CC=CC=C5

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C3=CSC(=[N+]3CCN4CCOCC4)NC5=CC=CC=C5

InChI

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