4-nitro-N-(thiophen-2-ylmethyl)-1,3-benzothiazol-5-amine

Systemtic Name: 4-nitro-N-(thiophen-2-ylmethyl)-1,3-benzothiazol-5-amine Openeye Name: 4-nitro-N-(2-thienylmethyl)-1,3-benzothiazol-5-amine CAS Name: 4-nitro-N-(thiophen-2-ylmethyl)-1,3-benzothiazol-5-amine IUPAC Name: 4-nitro-N-(thiophen-2-ylmethyl)-1,3-benzothiazol-5-amine Traditional Name: (4-nitro-1,3-benzothiazol-5-yl)-(2-thenyl)amine Formula: C12H9N3O2S2 MolecularWeight: 291.34876

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)CNC2=C(C3=C(C=C2)SC=N3)[N+](=O)[O-]

Isomeric SMILES

C1=CSC(=C1)CNC2=C(C3=C(C=C2)SC=N3)[N+](=O)[O-]

InChI

InChI=1S/C12H9N3O2S2/c16-15(17)12-9(13-6-8-2-1-5-18-8)3-4-10-11(12)14-7-19-10/h1-5,7,13H,6H2