1-[2-[4-(2-methyl-5-nitro-phenyl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethyl]pyrimidin-2-one

Systemtic Name: 1-[2-[4-(2-methyl-5-nitro-phenyl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethyl]pyrimidin-2-one Openeye Name: 1-[2-[4-(2-methyl-5-nitro-phenyl)sulfonylpiperazin-1-yl]-2-oxo-ethyl]pyrimidin-2-one CAS Name: 1-[2-[4-(2-methyl-5-nitrophenyl)sulfonyl-1-piperazinyl]-2-oxoethyl]-2-pyrimidinone IUPAC Name: 1-[2-[4-(2-methyl-5-nitrophenyl)sulfonylpiperazin-1-yl]-2-oxoethyl]pyrimidin-2-one Traditional Name: 1-[2-keto-2-[4-(2-methyl-5-nitro-phenyl)sulfonylpiperazino]ethyl]pyrimidin-2-one Formula: C17H19N5O6S MolecularWeight: 421.42766

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2CCN(CC2)C(=O)CN3C=CC=NC3=O

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2CCN(CC2)C(=O)CN3C=CC=NC3=O

InChI

InChI=1S/C17H19N5O6S/c1-13-3-4-14(22(25)26)11-15(13)29(27,28)21-9-7-19(8-10-21)16(23)12-20-6-2-5-18-17(20)24/h2-6,11H,7-10,12H2,1H3