ethyl 4-methyl-2-[[3-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]carbonylamino]-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 4-methyl-2-[[3-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]carbonylamino]-1,3-thiazole-5-carboxylate Openeye Name: ethyl 4-methyl-2-[[3-(4-methylpiperazin-4-ium-1-yl)sulfonylbenzoyl]amino]thiazole-5-carboxylate CAS Name: 4-methyl-2-[[[3-[(4-methyl-1-piperazin-4-iumyl)sulfonyl]phenyl]-oxomethyl]amino]-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-methyl-2-[[3-(4-methylpiperazin-4-ium-1-yl)sulfonylbenzoyl]amino]-1,3-thiazole-5-carboxylate Traditional Name: 4-methyl-2-[[3-(4-methylpiperazin-4-ium-1-yl)sulfonylbenzoyl]amino]thiazole-5-carboxylic acid ethyl ester Formula: C19H25N4O5S2+ MolecularWeight: 453.5556

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(S1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CC[NH+](CC3)C)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(S1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CC[NH+](CC3)C)C

InChI

InChI=1S/C19H24N4O5S2/c1-4-28-18(25)16-13(2)20-19(29-16)21-17(24)14-6-5-7-15(12-14)30(26,27)23-10-8-22(3)9-11-23/h5-7,12H,4,8-11H2,1-3H3,(H,20,21,24)/p+1