2-methyl-6-nitro-N-propyl-1,3-benzothiazol-5-amine

Systemtic Name: 2-methyl-6-nitro-N-propyl-1,3-benzothiazol-5-amine Openeye Name: 2-methyl-6-nitro-N-propyl-1,3-benzothiazol-5-amine CAS Name: 2-methyl-6-nitro-N-propyl-1,3-benzothiazol-5-amine IUPAC Name: 2-methyl-6-nitro-N-propyl-1,3-benzothiazol-5-amine Traditional Name: (2-methyl-6-nitro-1,3-benzothiazol-5-yl)-propyl-amine Formula: C11H13N3O2S MolecularWeight: 251.30482

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCNC1=C(C=C2C(=C1)N=C(S2)C)[N+](=O)[O-]

Isomeric SMILES

CCCNC1=C(C=C2C(=C1)N=C(S2)C)[N+](=O)[O-]

InChI

InChI=1S/C11H13N3O2S/c1-3-4-12-8-5-9-11(17-7(2)13-9)6-10(8)14(15)16/h5-6,12H,3-4H2,1-2H3