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

Systemtic Name: 4-methyl-5-[4-[2-(4-nitrophenoxy)ethanoyl]piperazin-1-yl]sulfonyl-3H-1,3-thiazol-2-one Openeye Name: 4-methyl-5-[4-[2-(4-nitrophenoxy)acetyl]piperazin-1-yl]sulfonyl-3H-thiazol-2-one CAS Name: 4-methyl-5-[[4-[2-(4-nitrophenoxy)-1-oxoethyl]-1-piperazinyl]sulfonyl]-3H-thiazol-2-one IUPAC Name: 4-methyl-5-[4-[2-(4-nitrophenoxy)acetyl]piperazin-1-yl]sulfonyl-3H-1,3-thiazol-2-one Traditional Name: 4-methyl-5-[4-[2-(4-nitrophenoxy)acetyl]piperazino]sulfonyl-4-thiazolin-2-one Formula: C16H18N4O7S2 MolecularWeight: 442.46672

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=O)N1)S(=O)(=O)N2CCN(CC2)C(=O)COC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(SC(=O)N1)S(=O)(=O)N2CCN(CC2)C(=O)COC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H18N4O7S2/c1-11-15(28-16(22)17-11)29(25,26)19-8-6-18(7-9-19)14(21)10-27-13-4-2-12(3-5-13)20(23)24/h2-5H,6-10H2,1H3,(H,17,22)