N-(2-methylpropyl)-6-nitro-1,3-benzothiazol-2-amine

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC1=NC2=C(S1)C=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)CNC1=NC2=C(S1)C=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C11H13N3O2S/c1-7(2)6-12-11-13-9-4-3-8(14(15)16)5-10(9)17-11/h3-5,7H,6H2,1-2H3,(H,12,13)