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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1NCC3=CC=NC=C3)[N+](=O)[O-])N=CS2

Isomeric SMILES

C1=CC2=C(C(=C1NCC3=CC=NC=C3)[N+](=O)[O-])N=CS2

InChI

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