4-[[4-(5-chloranylthiophen-2-yl)sulfonylpiperazin-1-ium-1-yl]methyl]-2-methyl-1,3-thiazole

Systemtic Name: 4-[[4-(5-chloranylthiophen-2-yl)sulfonylpiperazin-1-ium-1-yl]methyl]-2-methyl-1,3-thiazole Openeye Name: 4-[[4-[(5-chloro-2-thienyl)sulfonyl]piperazin-1-ium-1-yl]methyl]-2-methyl-thiazole CAS Name: 4-[[4-[(5-chloro-2-thiophenyl)sulfonyl]-1-piperazin-1-iumyl]methyl]-2-methylthiazole IUPAC Name: 4-[[4-(5-chlorothiophen-2-yl)sulfonylpiperazin-1-ium-1-yl]methyl]-2-methyl-1,3-thiazole Traditional Name: 4-[[4-[(5-chloro-2-thienyl)sulfonyl]piperazin-1-ium-1-yl]methyl]-2-methyl-thiazole Formula: C13H17ClN3O2S3+ MolecularWeight: 378.94098

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC=C(S3)Cl

Isomeric SMILES

CC1=NC(=CS1)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC=C(S3)Cl

InChI

InChI=1S/C13H16ClN3O2S3/c1-10-15-11(9-20-10)8-16-4-6-17(7-5-16)22(18,19)13-3-2-12(14)21-13/h2-3,9H,4-8H2,1H3/p+1