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

Systemtic Name: 3-(3-methoxypropyl)-N-phenyl-4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-3-ium-2-amine Openeye Name: 3-(3-methoxypropyl)-N-phenyl-4-[4-(1-piperidylsulfonyl)phenyl]thiazol-3-ium-2-amine CAS Name: 3-(3-methoxypropyl)-N-phenyl-4-[4-(1-piperidinylsulfonyl)phenyl]-2-thiazol-3-iumamine IUPAC Name: 3-(3-methoxypropyl)-N-phenyl-4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-3-ium-2-amine Traditional Name: [3-(3-methoxypropyl)-4-(4-piperidinosulfonylphenyl)thiazol-3-ium-2-yl]-phenyl-amine Formula: C24H30N3O3S2+ MolecularWeight: 472.6433

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Descriptors Computed from Structure

Canonical SMILES:

COCCC[N+]1=C(SC=C1C2=CC=C(C=C2)S(=O)(=O)N3CCCCC3)NC4=CC=CC=C4

Isomeric SMILES

COCCC[N+]1=C(SC=C1C2=CC=C(C=C2)S(=O)(=O)N3CCCCC3)NC4=CC=CC=C4

InChI

InChI=1S/C24H29N3O3S2/c1-30-18-8-17-27-23(19-31-24(27)25-21-9-4-2-5-10-21)20-11-13-22(14-12-20)32(28,29)26-15-6-3-7-16-26/h2,4-5,9-14,19H,3,6-8,15-18H2,1H3/p+1