ethyl N-[6-diazenyl-5-(3,5,5-trimethylhexoxy)-1,3-benzothiazol-2-yl]-N-hexyl-carbamate

Systemtic Name: ethyl N-[6-diazenyl-5-(3,5,5-trimethylhexoxy)-1,3-benzothiazol-2-yl]-N-hexyl-carbamate Openeye Name: ethyl N-[6-diazenyl-5-(3,5,5-trimethylhexoxy)-1,3-benzothiazol-2-yl]-N-hexyl-carbamate CAS Name: N-[6-diazenyl-5-(3,5,5-trimethylhexoxy)-1,3-benzothiazol-2-yl]-N-hexylcarbamic acid ethyl ester IUPAC Name: ethyl N-[6-diazenyl-5-(3,5,5-trimethylhexoxy)-1,3-benzothiazol-2-yl]-N-hexylcarbamate Traditional Name: N-[6-diazenyl-5-(3,5,5-trimethylhexoxy)-1,3-benzothiazol-2-yl]-N-hexyl-carbamic acid ethyl ester Formula: C25H40N4O3S MolecularWeight: 476.6751

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN(C1=NC2=CC(=C(C=C2S1)N=N)OCCC(C)CC(C)(C)C)C(=O)OCC

Isomeric SMILES

CCCCCCN(C1=NC2=CC(=C(C=C2S1)N=N)OCCC(C)CC(C)(C)C)C(=O)OCC

InChI

InChI=1S/C25H40N4O3S/c1-7-9-10-11-13-29(24(30)31-8-2)23-27-20-15-21(19(28-26)16-22(20)33-23)32-14-12-18(3)17-25(4,5)6/h15-16,18,26H,7-14,17H2,1-6H3