N5-(pyridin-2-ylmethyl)-1,3-benzothiazole-4,5-diamine

Systemtic Name: N5-(pyridin-2-ylmethyl)-1,3-benzothiazole-4,5-diamine Openeye Name: N5-(2-pyridylmethyl)-1,3-benzothiazole-4,5-diamine CAS Name: N5-(2-pyridinylmethyl)-1,3-benzothiazole-4,5-diamine IUPAC Name: 5-N-(pyridin-2-ylmethyl)-1,3-benzothiazole-4,5-diamine Traditional Name: (4-amino-1,3-benzothiazol-5-yl)-(2-pyridylmethyl)amine Formula: C13H12N4S MolecularWeight: 256.32618

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)CNC2=C(C3=C(C=C2)SC=N3)N

Isomeric SMILES

C1=CC=NC(=C1)CNC2=C(C3=C(C=C2)SC=N3)N

InChI

InChI=1S/C13H12N4S/c14-12-10(4-5-11-13(12)17-8-18-11)16-7-9-3-1-2-6-15-9/h1-6,8,16H,7,14H2