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

Systemtic Name: 6-nitro-N-(pyridin-4-ylmethyl)-1,3-benzothiazol-2-amine Openeye Name: 6-nitro-N-(4-pyridylmethyl)-1,3-benzothiazol-2-amine CAS Name: 6-nitro-N-(pyridin-4-ylmethyl)-1,3-benzothiazol-2-amine IUPAC Name: 6-nitro-N-(pyridin-4-ylmethyl)-1,3-benzothiazol-2-amine Traditional Name: (6-nitro-1,3-benzothiazol-2-yl)-(4-pyridylmethyl)amine Formula: C13H10N4O2S MolecularWeight: 286.3091

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1[N+](=O)[O-])SC(=N2)NCC3=CC=NC=C3

Isomeric SMILES

C1=CC2=C(C=C1[N+](=O)[O-])SC(=N2)NCC3=CC=NC=C3

InChI

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