5-methyl-1-[2-[4-(2-nitrophenyl)sulfonyl-3-oxidanylidene-2-phenyl-piperazin-1-yl]-2-oxidanylidene-ethyl]pyrimidine-2,4-dione

Systemtic Name: 5-methyl-1-[2-[4-(2-nitrophenyl)sulfonyl-3-oxidanylidene-2-phenyl-piperazin-1-yl]-2-oxidanylidene-ethyl]pyrimidine-2,4-dione Openeye Name: 5-methyl-1-[2-[4-(2-nitrophenyl)sulfonyl-3-oxo-2-phenyl-piperazin-1-yl]-2-oxo-ethyl]pyrimidine-2,4-dione CAS Name: 5-methyl-1-[2-[4-(2-nitrophenyl)sulfonyl-3-oxo-2-phenyl-1-piperazinyl]-2-oxoethyl]pyrimidine-2,4-dione IUPAC Name: 5-methyl-1-[2-[4-(2-nitrophenyl)sulfonyl-3-oxo-2-phenylpiperazin-1-yl]-2-oxoethyl]pyrimidine-2,4-dione Traditional Name: 1-[2-keto-2-[3-keto-4-(2-nitrophenyl)sulfonyl-2-phenyl-piperazino]ethyl]-5-methyl-pyrimidine-2,4-quinone Formula: C23H21N5O8S MolecularWeight: 527.50654

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C(=O)NC1=O)CC(=O)N2CCN(C(=O)C2C3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

CC1=CN(C(=O)NC1=O)CC(=O)N2CCN(C(=O)C2C3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C23H21N5O8S/c1-15-13-25(23(32)24-21(15)30)14-19(29)26-11-12-27(22(31)20(26)16-7-3-2-4-8-16)37(35,36)18-10-6-5-9-17(18)28(33)34/h2-10,13,20H,11-12,14H2,1H3,(H,24,30,32)