N'-(2-methyl-6-nitro-1,3-benzothiazol-5-yl)propane-1,3-diamine

Systemtic Name: N'-(2-methyl-6-nitro-1,3-benzothiazol-5-yl)propane-1,3-diamine Openeye Name: N'-(2-methyl-6-nitro-1,3-benzothiazol-5-yl)propane-1,3-diamine CAS Name: N'-(2-methyl-6-nitro-1,3-benzothiazol-5-yl)propane-1,3-diamine IUPAC Name: N'-(2-methyl-6-nitro-1,3-benzothiazol-5-yl)propane-1,3-diamine Traditional Name: 3-aminopropyl-(2-methyl-6-nitro-1,3-benzothiazol-5-yl)amine Formula: C11H14N4O2S MolecularWeight: 266.31946

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC(=C(C=C2S1)[N+](=O)[O-])NCCCN

Isomeric SMILES

CC1=NC2=CC(=C(C=C2S1)[N+](=O)[O-])NCCCN

InChI

InChI=1S/C11H14N4O2S/c1-7-14-9-5-8(13-4-2-3-12)10(15(16)17)6-11(9)18-7/h5-6,13H,2-4,12H2,1H3