N-octadecyl-1,3-benzothiazol-2-amine

Systemtic Name: N-octadecyl-1,3-benzothiazol-2-amine Openeye Name: N-octadecyl-1,3-benzothiazol-2-amine CAS Name: N-octadecyl-1,3-benzothiazol-2-amine IUPAC Name: N-octadecyl-1,3-benzothiazol-2-amine Traditional Name: 1,3-benzothiazol-2-yl(stearyl)amine Formula: C25H42N2S MolecularWeight: 402.67938

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNC1=NC2=CC=CC=C2S1

Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC1=NC2=CC=CC=C2S1

InChI

InChI=1S/C25H42N2S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-22-26-25-27-23-20-17-18-21-24(23)28-25/h17-18,20-21H,2-16,19,22H2,1H3,(H,26,27)