1,3-benzothiazol-2-ylmethyl 2-[2-(4-ethylphenyl)-1,3-thiazol-4-yl]ethanoate

Systemtic Name: 1,3-benzothiazol-2-ylmethyl 2-[2-(4-ethylphenyl)-1,3-thiazol-4-yl]ethanoate Openeye Name: 1,3-benzothiazol-2-ylmethyl 2-[2-(4-ethylphenyl)thiazol-4-yl]acetate CAS Name: 2-[2-(4-ethylphenyl)-4-thiazolyl]acetic acid 1,3-benzothiazol-2-ylmethyl ester IUPAC Name: 1,3-benzothiazol-2-ylmethyl 2-[2-(4-ethylphenyl)-1,3-thiazol-4-yl]acetate Traditional Name: 2-[2-(4-ethylphenyl)thiazol-4-yl]acetic acid 1,3-benzothiazol-2-ylmethyl ester Formula: C21H18N2O2S2 MolecularWeight: 394.50982

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NC(=CS2)CC(=O)OCC3=NC4=CC=CC=C4S3

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NC(=CS2)CC(=O)OCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H18N2O2S2/c1-2-14-7-9-15(10-8-14)21-22-16(13-26-21)11-20(24)25-12-19-23-17-5-3-4-6-18(17)27-19/h3-10,13H,2,11-12H2,1H3