1-[1-(2-azanylidene-3-methyl-1,3-thiazol-5-yl)piperazin-1-ium-1-yl]-3-(6-chloranylnaphthalen-2-yl)sulfonyl-propan-1-one

Systemtic Name: 1-[1-(2-azanylidene-3-methyl-1,3-thiazol-5-yl)piperazin-1-ium-1-yl]-3-(6-chloranylnaphthalen-2-yl)sulfonyl-propan-1-one Openeye Name: 3-[(6-chloro-2-naphthyl)sulfonyl]-1-[1-(2-imino-3-methyl-thiazol-5-yl)piperazin-1-ium-1-yl]propan-1-one CAS Name: 3-[(6-chloro-2-naphthalenyl)sulfonyl]-1-[1-(2-imino-3-methyl-5-thiazolyl)-1-piperazin-1-iumyl]-1-propanone IUPAC Name: 3-(6-chloronaphthalen-2-yl)sulfonyl-1-[1-(2-imino-3-methyl-1,3-thiazol-5-yl)piperazin-1-ium-1-yl]propan-1-one Traditional Name: 3-[(6-chloro-2-naphthyl)sulfonyl]-1-[1-(2-imino-3-methyl-4-thiazolin-5-yl)piperazin-1-ium-1-yl]propan-1-one Formula: C21H24ClN4O3S2+ MolecularWeight: 480.02326

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(SC1=N)[N+]2(CCNCC2)C(=O)CCS(=O)(=O)C3=CC4=C(C=C3)C=C(C=C4)Cl

Isomeric SMILES

CN1C=C(SC1=N)[N+]2(CCNCC2)C(=O)CCS(=O)(=O)C3=CC4=C(C=C3)C=C(C=C4)Cl

InChI

InChI=1S/C21H24ClN4O3S2/c1-25-14-20(30-21(25)23)26(9-7-24-8-10-26)19(27)6-11-31(28,29)18-5-3-15-12-17(22)4-2-16(15)13-18/h2-5,12-14,23-24H,6-11H2,1H3/q+1