3-(2-azanylethyl)-4-[6-(2-naphthalen-1-ylethoxy)hexyl]-1,3-benzothiazol-2-one

Systemtic Name: 3-(2-azanylethyl)-4-[6-(2-naphthalen-1-ylethoxy)hexyl]-1,3-benzothiazol-2-one Openeye Name: 3-(2-aminoethyl)-4-[6-[2-(1-naphthyl)ethoxy]hexyl]-1,3-benzothiazol-2-one CAS Name: 3-(2-aminoethyl)-4-[6-[2-(1-naphthalenyl)ethoxy]hexyl]-1,3-benzothiazol-2-one IUPAC Name: 3-(2-aminoethyl)-4-[6-(2-naphthalen-1-ylethoxy)hexyl]-1,3-benzothiazol-2-one Traditional Name: 3-(2-aminoethyl)-4-[6-[2-(1-naphthyl)ethoxy]hexyl]-1,3-benzothiazol-2-one Formula: C27H32N2O2S MolecularWeight: 448.62018

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2CCOCCCCCCC3=C4C(=CC=C3)SC(=O)N4CCN

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2CCOCCCCCCC3=C4C(=CC=C3)SC(=O)N4CCN

InChI

InChI=1S/C27H32N2O2S/c28-17-18-29-26-23(13-8-15-25(26)32-27(29)30)10-3-1-2-6-19-31-20-16-22-12-7-11-21-9-4-5-14-24(21)22/h4-5,7-9,11-15H,1-3,6,10,16-20,28H2