4-methyl-5-[4-[2-(2-nitrophenyl)ethanoyl]piperazin-1-yl]sulfonyl-3H-1,3-thiazol-2-one

Systemtic Name: 4-methyl-5-[4-[2-(2-nitrophenyl)ethanoyl]piperazin-1-yl]sulfonyl-3H-1,3-thiazol-2-one Openeye Name: 4-methyl-5-[4-[2-(2-nitrophenyl)acetyl]piperazin-1-yl]sulfonyl-3H-thiazol-2-one CAS Name: 4-methyl-5-[[4-[2-(2-nitrophenyl)-1-oxoethyl]-1-piperazinyl]sulfonyl]-3H-thiazol-2-one IUPAC Name: 4-methyl-5-[4-[2-(2-nitrophenyl)acetyl]piperazin-1-yl]sulfonyl-3H-1,3-thiazol-2-one Traditional Name: 4-methyl-5-[4-[2-(2-nitrophenyl)acetyl]piperazino]sulfonyl-4-thiazolin-2-one Formula: C16H18N4O6S2 MolecularWeight: 426.46732

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=O)N1)S(=O)(=O)N2CCN(CC2)C(=O)CC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CC1=C(SC(=O)N1)S(=O)(=O)N2CCN(CC2)C(=O)CC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C16H18N4O6S2/c1-11-15(27-16(22)17-11)28(25,26)19-8-6-18(7-9-19)14(21)10-12-4-2-3-5-13(12)20(23)24/h2-5H,6-10H2,1H3,(H,17,22)