N-(3,4-dimethylphenyl)-3-ethyl-4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-3-ium-2-amine

Systemtic Name: N-(3,4-dimethylphenyl)-3-ethyl-4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-3-ium-2-amine Openeye Name: N-(3,4-dimethylphenyl)-3-ethyl-4-[4-(1-piperidylsulfonyl)phenyl]thiazol-3-ium-2-amine CAS Name: N-(3,4-dimethylphenyl)-3-ethyl-4-[4-(1-piperidinylsulfonyl)phenyl]-2-thiazol-3-iumamine IUPAC Name: N-(3,4-dimethylphenyl)-3-ethyl-4-(4-piperidin-1-ylsulfonylphenyl)-1,3-thiazol-3-ium-2-amine Traditional Name: (3,4-dimethylphenyl)-[3-ethyl-4-(4-piperidinosulfonylphenyl)thiazol-3-ium-2-yl]amine Formula: C24H30N3O2S2+ MolecularWeight: 456.6439

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H29N3O2S2/c1-4-27-23(17-30-24(27)25-21-11-8-18(2)19(3)16-21)20-9-12-22(13-10-20)31(28,29)26-14-6-5-7-15-26/h8-13,16-17H,4-7,14-15H2,1-3H3/p+1