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

Systemtic Name: 4-[[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazin-1-yl]methyl]-2-methyl-1,3-thiazole Openeye Name: 4-[[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazin-1-yl]methyl]-2-methyl-thiazole CAS Name: 4-[[4-(4-methoxy-3-nitrophenyl)sulfonyl-1-piperazinyl]methyl]-2-methylthiazole IUPAC Name: 4-[[4-(4-methoxy-3-nitrophenyl)sulfonylpiperazin-1-yl]methyl]-2-methyl-1,3-thiazole Traditional Name: 4-[[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazino]methyl]-2-methyl-thiazole Formula: C16H20N4O5S2 MolecularWeight: 412.4838

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)CN2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=NC(=CS1)CN2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)OC)[N+](=O)[O-]

InChI

InChI=1S/C16H20N4O5S2/c1-12-17-13(11-26-12)10-18-5-7-19(8-6-18)27(23,24)14-3-4-16(25-2)15(9-14)20(21)22/h3-4,9,11H,5-8,10H2,1-2H3