4-methyl-3-(1-methyl-5-nitro-imidazol-2-yl)-5-propylsulfonyl-1,2,4-triazole

Systemtic Name: 4-methyl-3-(1-methyl-5-nitro-imidazol-2-yl)-5-propylsulfonyl-1,2,4-triazole Openeye Name: 4-methyl-3-(1-methyl-5-nitro-imidazol-2-yl)-5-propylsulfonyl-1,2,4-triazole CAS Name: 4-methyl-3-(1-methyl-5-nitro-2-imidazolyl)-5-propylsulfonyl-1,2,4-triazole IUPAC Name: 4-methyl-3-(1-methyl-5-nitroimidazol-2-yl)-5-propylsulfonyl-1,2,4-triazole Traditional Name: 4-methyl-3-(1-methyl-5-nitro-imidazol-2-yl)-5-propylsulfonyl-1,2,4-triazole Formula: C10H14N6O4S MolecularWeight: 314.32096

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)C1=NN=C(N1C)C2=NC=C(N2C)[N+](=O)[O-]

Isomeric SMILES

CCCS(=O)(=O)C1=NN=C(N1C)C2=NC=C(N2C)[N+](=O)[O-]

InChI

InChI=1S/C10H14N6O4S/c1-4-5-21(19,20)10-13-12-9(15(10)3)8-11-6-7(14(8)2)16(17)18/h6H,4-5H2,1-3H3