5-[4-(2-chloranyl-4-nitro-phenyl)piperazin-1-yl]sulfonyl-4-methyl-3H-1,3-thiazol-2-one

Systemtic Name: 5-[4-(2-chloranyl-4-nitro-phenyl)piperazin-1-yl]sulfonyl-4-methyl-3H-1,3-thiazol-2-one Openeye Name: 5-[4-(2-chloro-4-nitro-phenyl)piperazin-1-yl]sulfonyl-4-methyl-3H-thiazol-2-one CAS Name: 5-[[4-(2-chloro-4-nitrophenyl)-1-piperazinyl]sulfonyl]-4-methyl-3H-thiazol-2-one IUPAC Name: 5-[4-(2-chloro-4-nitrophenyl)piperazin-1-yl]sulfonyl-4-methyl-3H-1,3-thiazol-2-one Traditional Name: 5-[4-(2-chloro-4-nitro-phenyl)piperazino]sulfonyl-4-methyl-4-thiazolin-2-one Formula: C14H15ClN4O5S2 MolecularWeight: 418.8757

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=O)N1)S(=O)(=O)N2CCN(CC2)C3=C(C=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=C(SC(=O)N1)S(=O)(=O)N2CCN(CC2)C3=C(C=C(C=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C14H15ClN4O5S2/c1-9-13(25-14(20)16-9)26(23,24)18-6-4-17(5-7-18)12-3-2-10(19(21)22)8-11(12)15/h2-3,8H,4-7H2,1H3,(H,16,20)