4-methyl-N'-[6-(2-morpholin-4-ylethylamino)-5-nitro-pyrimidin-4-yl]benzenesulfonohydrazide

Systemtic Name: 4-methyl-N'-[6-(2-morpholin-4-ylethylamino)-5-nitro-pyrimidin-4-yl]benzenesulfonohydrazide Openeye Name: 4-methyl-N'-[6-(2-morpholinoethylamino)-5-nitro-pyrimidin-4-yl]benzenesulfonohydrazide CAS Name: 4-methyl-N'-[6-[2-(4-morpholinyl)ethylamino]-5-nitro-4-pyrimidinyl]benzenesulfonohydrazide IUPAC Name: 4-methyl-N'-[6-(2-morpholin-4-ylethylamino)-5-nitropyrimidin-4-yl]benzenesulfonohydrazide Traditional Name: 4-methyl-N'-[6-(2-morpholinoethylamino)-5-nitro-pyrimidin-4-yl]benzenesulfonohydrazide Formula: C17H23N7O5S MolecularWeight: 437.47342

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NNC2=NC=NC(=C2[N+](=O)[O-])NCCN3CCOCC3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NNC2=NC=NC(=C2[N+](=O)[O-])NCCN3CCOCC3

InChI

InChI=1S/C17H23N7O5S/c1-13-2-4-14(5-3-13)30(27,28)22-21-17-15(24(25)26)16(19-12-20-17)18-6-7-23-8-10-29-11-9-23/h2-5,12,22H,6-11H2,1H3,(H2,18,19,20,21)