4-methyl-N'-[6-(naphthalen-1-ylamino)-5-nitro-pyrimidin-4-yl]benzenesulfonohydrazide

Systemtic Name: 4-methyl-N'-[6-(naphthalen-1-ylamino)-5-nitro-pyrimidin-4-yl]benzenesulfonohydrazide Openeye Name: 4-methyl-N'-[6-(1-naphthylamino)-5-nitro-pyrimidin-4-yl]benzenesulfonohydrazide CAS Name: 4-methyl-N'-[6-(1-naphthalenylamino)-5-nitro-4-pyrimidinyl]benzenesulfonohydrazide IUPAC Name: 4-methyl-N'-[6-(naphthalen-1-ylamino)-5-nitropyrimidin-4-yl]benzenesulfonohydrazide Traditional Name: 4-methyl-N'-[6-(1-naphthylamino)-5-nitro-pyrimidin-4-yl]benzenesulfonohydrazide Formula: C21H18N6O4S MolecularWeight: 450.47042

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NNC2=NC=NC(=C2[N+](=O)[O-])NC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NNC2=NC=NC(=C2[N+](=O)[O-])NC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C21H18N6O4S/c1-14-9-11-16(12-10-14)32(30,31)26-25-21-19(27(28)29)20(22-13-23-21)24-18-8-4-6-15-5-2-3-7-17(15)18/h2-13,26H,1H3,(H2,22,23,24,25)