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

Systemtic Name: 4-nitro-N-(pyridin-2-ylmethyl)-1,3-benzothiazol-5-amine Openeye Name: 4-nitro-N-(2-pyridylmethyl)-1,3-benzothiazol-5-amine CAS Name: 4-nitro-N-(2-pyridinylmethyl)-1,3-benzothiazol-5-amine IUPAC Name: 4-nitro-N-(pyridin-2-ylmethyl)-1,3-benzothiazol-5-amine Traditional Name: (4-nitro-1,3-benzothiazol-5-yl)-(2-pyridylmethyl)amine Formula: C13H10N4O2S MolecularWeight: 286.3091

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H10N4O2S/c18-17(19)13-10(4-5-11-12(13)16-8-20-11)15-7-9-3-1-2-6-14-9/h1-6,8,15H,7H2