N-methyl-5-(2-nitrophenoxy)-1,1-bis(oxidanylidene)-4-propan-2-yl-1,2,4,6-thiatriazin-3-amine

Systemtic Name: N-methyl-5-(2-nitrophenoxy)-1,1-bis(oxidanylidene)-4-propan-2-yl-1,2,4,6-thiatriazin-3-amine Openeye Name: 4-isopropyl-N-methyl-5-(2-nitrophenoxy)-1,1-dioxo-1,2,4,6-thiatriazin-3-amine CAS Name: N-methyl-5-(2-nitrophenoxy)-1,1-dioxo-4-propan-2-yl-1,2,4,6-thiatriazin-3-amine IUPAC Name: N-methyl-5-(2-nitrophenoxy)-1,1-dioxo-4-propan-2-yl-1,2,4,6-thiatriazin-3-amine Traditional Name: [4-isopropyl-1,1-diketo-5-(2-nitrophenoxy)-1,2,4,6-thiatriazin-3-yl]-methyl-amine Formula: C12H15N5O5S MolecularWeight: 341.343

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=NS(=O)(=O)N=C1OC2=CC=CC=C2[N+](=O)[O-])NC

Isomeric SMILES

CC(C)N1C(=NS(=O)(=O)N=C1OC2=CC=CC=C2[N+](=O)[O-])NC

InChI

InChI=1S/C12H15N5O5S/c1-8(2)16-11(13-3)14-23(20,21)15-12(16)22-10-7-5-4-6-9(10)17(18)19/h4-8H,1-3H3,(H,13,14)