4-[6-[4-(4-methyl-3,5-dinitro-phenyl)sulfonylpiperazin-1-yl]pyrimidin-4-yl]morpholine

Systemtic Name: 4-[6-[4-(4-methyl-3,5-dinitro-phenyl)sulfonylpiperazin-1-yl]pyrimidin-4-yl]morpholine Openeye Name: 4-[6-[4-(4-methyl-3,5-dinitro-phenyl)sulfonylpiperazin-1-yl]pyrimidin-4-yl]morpholine CAS Name: 4-[6-[4-(4-methyl-3,5-dinitrophenyl)sulfonyl-1-piperazinyl]-4-pyrimidinyl]morpholine IUPAC Name: 4-[6-[4-(4-methyl-3,5-dinitrophenyl)sulfonylpiperazin-1-yl]pyrimidin-4-yl]morpholine Traditional Name: 4-[6-[4-(4-methyl-3,5-dinitro-phenyl)sulfonylpiperazino]pyrimidin-4-yl]morpholine Formula: C19H23N7O7S MolecularWeight: 493.49362

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1[N+](=O)[O-])S(=O)(=O)N2CCN(CC2)C3=CC(=NC=N3)N4CCOCC4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1[N+](=O)[O-])S(=O)(=O)N2CCN(CC2)C3=CC(=NC=N3)N4CCOCC4)[N+](=O)[O-]

InChI

InChI=1S/C19H23N7O7S/c1-14-16(25(27)28)10-15(11-17(14)26(29)30)34(31,32)24-4-2-22(3-5-24)18-12-19(21-13-20-18)23-6-8-33-9-7-23/h10-13H,2-9H2,1H3