N-[6-ethoxy-3-(2-methylsulfanylethyl)-1,3-benzothiazol-2-ylidene]-2-(4-ethoxyphenyl)ethanamide

Systemtic Name: N-[6-ethoxy-3-(2-methylsulfanylethyl)-1,3-benzothiazol-2-ylidene]-2-(4-ethoxyphenyl)ethanamide Openeye Name: N-[6-ethoxy-3-(2-methylsulfanylethyl)-1,3-benzothiazol-2-ylidene]-2-(4-ethoxyphenyl)acetamide CAS Name: N-[6-ethoxy-3-[2-(methylthio)ethyl]-1,3-benzothiazol-2-ylidene]-2-(4-ethoxyphenyl)acetamide IUPAC Name: N-[6-ethoxy-3-(2-methylsulfanylethyl)-1,3-benzothiazol-2-ylidene]-2-(4-ethoxyphenyl)acetamide Traditional Name: N-[6-ethoxy-3-[2-(methylthio)ethyl]-1,3-benzothiazol-2-ylidene]-2-p-phenetyl-acetamide Formula: C22H26N2O3S2 MolecularWeight: 430.58344

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CC(=O)N=C2N(C3=C(S2)C=C(C=C3)OCC)CCSC

Isomeric SMILES

CCOC1=CC=C(C=C1)CC(=O)N=C2N(C3=C(S2)C=C(C=C3)OCC)CCSC

InChI

InChI=1S/C22H26N2O3S2/c1-4-26-17-8-6-16(7-9-17)14-21(25)23-22-24(12-13-28-3)19-11-10-18(27-5-2)15-20(19)29-22/h6-11,15H,4-5,12-14H2,1-3H3