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

Systemtic Name: 4-methyl-N'-[5-nitro-6-(2-thiophen-2-ylethylamino)pyrimidin-4-yl]benzenesulfonohydrazide Openeye Name: 4-methyl-N'-[5-nitro-6-[2-(2-thienyl)ethylamino]pyrimidin-4-yl]benzenesulfonohydrazide CAS Name: 4-methyl-N'-[5-nitro-6-(2-thiophen-2-ylethylamino)-4-pyrimidinyl]benzenesulfonohydrazide IUPAC Name: 4-methyl-N'-[5-nitro-6-(2-thiophen-2-ylethylamino)pyrimidin-4-yl]benzenesulfonohydrazide Traditional Name: 4-methyl-N'-[5-nitro-6-[2-(2-thienyl)ethylamino]pyrimidin-4-yl]benzenesulfonohydrazide Formula: C17H18N6O4S2 MolecularWeight: 434.49262

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-])NCCC3=CC=CS3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NNC2=NC=NC(=C2[N+](=O)[O-])NCCC3=CC=CS3

InChI

InChI=1S/C17H18N6O4S2/c1-12-4-6-14(7-5-12)29(26,27)22-21-17-15(23(24)25)16(19-11-20-17)18-9-8-13-3-2-10-28-13/h2-7,10-11,22H,8-9H2,1H3,(H2,18,19,20,21)