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2-(6-dodecoxy-1,3-benzothiazol-2-yl)-2-phenoxy-ethanenitrile

2-(6-dodecoxy-1,3-benzothiazol-2-yl)-2-phenoxy-ethanenitrile

Systemtic Name:2-(6-dodecoxy-1,3-benzothiazol-2-yl)-2-phenoxy-ethanenitrile
Openeye Name:2-(6-dodecoxy-1,3-benzothiazol-2-yl)-2-phenoxy-acetonitrile
CAS Name:2-(6-dodecoxy-1,3-benzothiazol-2-yl)-2-phenoxyacetonitrile
IUPAC Name:2-(6-dodecoxy-1,3-benzothiazol-2-yl)-2-phenoxyacetonitrile
Traditional Name:2-(6-lauryloxy-1,3-benzothiazol-2-yl)-2-phenoxy-acetonitrile
Formula: C27H34N2O2S
MolecularWeight: 450.63606
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=CC2=C(C=C1)N=C(S2)C(C#N)OC3=CC=CC=C3


Isomeric SMILES

CCCCCCCCCCCCOC1=CC2=C(C=C1)N=C(S2)C(C#N)OC3=CC=CC=C3


InChI

InChI=1S/C27H34N2O2S/c1-2-3-4-5-6-7-8-9-10-14-19-30-23-17-18-24-26(20-23)32-27(29-24)25(21-28)31-22-15-12-11-13-16-22/h11-13,15-18,20,25H,2-10,14,19H2,1H3


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