5-(4-ethylpiperazin-4-ium-1-yl)-4-(4-methylphenyl)sulfonyl-2-propylsulfonyl-1,3-thiazole

Systemtic Name: 5-(4-ethylpiperazin-4-ium-1-yl)-4-(4-methylphenyl)sulfonyl-2-propylsulfonyl-1,3-thiazole Openeye Name: 5-(4-ethylpiperazin-4-ium-1-yl)-2-propylsulfonyl-4-(p-tolylsulfonyl)thiazole CAS Name: 5-(4-ethyl-1-piperazin-4-iumyl)-4-(4-methylphenyl)sulfonyl-2-propylsulfonylthiazole IUPAC Name: 5-(4-ethylpiperazin-4-ium-1-yl)-4-(4-methylphenyl)sulfonyl-2-propylsulfonyl-1,3-thiazole Traditional Name: 5-(4-ethylpiperazin-4-ium-1-yl)-2-propylsulfonyl-4-tosyl-thiazole Formula: C19H28N3O4S3+ MolecularWeight: 458.63832

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)C1=NC(=C(S1)N2CC[NH+](CC2)CC)S(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCCS(=O)(=O)C1=NC(=C(S1)N2CC[NH+](CC2)CC)S(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C19H27N3O4S3/c1-4-14-28(23,24)19-20-17(29(25,26)16-8-6-15(3)7-9-16)18(27-19)22-12-10-21(5-2)11-13-22/h6-9H,4-5,10-14H2,1-3H3/p+1