N-butan-2-yl-4-nitro-1,3-benzothiazol-5-amine

Systemtic Name: N-butan-2-yl-4-nitro-1,3-benzothiazol-5-amine Openeye Name: 4-nitro-N-sec-butyl-1,3-benzothiazol-5-amine CAS Name: N-butan-2-yl-4-nitro-1,3-benzothiazol-5-amine IUPAC Name: N-butan-2-yl-4-nitro-1,3-benzothiazol-5-amine Traditional Name: (4-nitro-1,3-benzothiazol-5-yl)-sec-butyl-amine Formula: C11H13N3O2S MolecularWeight: 251.30482

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC1=C(C2=C(C=C1)SC=N2)[N+](=O)[O-]

Isomeric SMILES

CCC(C)NC1=C(C2=C(C=C1)SC=N2)[N+](=O)[O-]

InChI

InChI=1S/C11H13N3O2S/c1-3-7(2)13-8-4-5-9-10(12-6-17-9)11(8)14(15)16/h4-7,13H,3H2,1-2H3