4-(furan-2-yl)-2-[[4-(2-methyl-5-nitro-phenyl)sulfonylpiperazin-1-yl]methyl]-1,3-thiazole

Systemtic Name: 4-(furan-2-yl)-2-[[4-(2-methyl-5-nitro-phenyl)sulfonylpiperazin-1-yl]methyl]-1,3-thiazole Openeye Name: 4-(2-furyl)-2-[[4-(2-methyl-5-nitro-phenyl)sulfonylpiperazin-1-yl]methyl]thiazole CAS Name: 4-(2-furanyl)-2-[[4-(2-methyl-5-nitrophenyl)sulfonyl-1-piperazinyl]methyl]thiazole IUPAC Name: 4-(furan-2-yl)-2-[[4-(2-methyl-5-nitrophenyl)sulfonylpiperazin-1-yl]methyl]-1,3-thiazole Traditional Name: 4-(2-furyl)-2-[[4-(2-methyl-5-nitro-phenyl)sulfonylpiperazino]methyl]thiazole Formula: C19H20N4O5S2 MolecularWeight: 448.5159

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2CCN(CC2)CC3=NC(=CS3)C4=CC=CO4

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2CCN(CC2)CC3=NC(=CS3)C4=CC=CO4

InChI

InChI=1S/C19H20N4O5S2/c1-14-4-5-15(23(24)25)11-18(14)30(26,27)22-8-6-21(7-9-22)12-19-20-16(13-29-19)17-3-2-10-28-17/h2-5,10-11,13H,6-9,12H2,1H3