2-[4-(2-methoxy-5-octyl-phenyl)-1,3-thiazol-2-yl]ethanamine

Systemtic Name: 2-[4-(2-methoxy-5-octyl-phenyl)-1,3-thiazol-2-yl]ethanamine Openeye Name: 2-[4-(2-methoxy-5-octyl-phenyl)thiazol-2-yl]ethanamine CAS Name: 2-[4-(2-methoxy-5-octylphenyl)-2-thiazolyl]ethanamine IUPAC Name: 2-[4-(2-methoxy-5-octylphenyl)-1,3-thiazol-2-yl]ethanamine Traditional Name: 2-[4-(2-methoxy-5-octyl-phenyl)thiazol-2-yl]ethylamine Formula: C20H30N2OS MolecularWeight: 346.53

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC(=C(C=C1)OC)C2=CSC(=N2)CCN

Isomeric SMILES

CCCCCCCCC1=CC(=C(C=C1)OC)C2=CSC(=N2)CCN

InChI

InChI=1S/C20H30N2OS/c1-3-4-5-6-7-8-9-16-10-11-19(23-2)17(14-16)18-15-24-20(22-18)12-13-21/h10-11,14-15H,3-9,12-13,21H2,1-2H3