ethyl 2-[[6-[2-(2-methylphenoxy)ethanoylamino]-1,3-benzothiazol-2-yl]sulfanyl]ethanoate

Systemtic Name: ethyl 2-[[6-[2-(2-methylphenoxy)ethanoylamino]-1,3-benzothiazol-2-yl]sulfanyl]ethanoate Openeye Name: ethyl 2-[[6-[[2-(2-methylphenoxy)acetyl]amino]-1,3-benzothiazol-2-yl]sulfanyl]acetate CAS Name: 2-[[6-[[2-(2-methylphenoxy)-1-oxoethyl]amino]-1,3-benzothiazol-2-yl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[[6-[[2-(2-methylphenoxy)acetyl]amino]-1,3-benzothiazol-2-yl]sulfanyl]acetate Traditional Name: 2-[[6-[[2-(2-methylphenoxy)acetyl]amino]-1,3-benzothiazol-2-yl]thio]acetic acid ethyl ester Formula: C20H20N2O4S2 MolecularWeight: 416.5138

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=NC2=C(S1)C=C(C=C2)NC(=O)COC3=CC=CC=C3C

Isomeric SMILES

CCOC(=O)CSC1=NC2=C(S1)C=C(C=C2)NC(=O)COC3=CC=CC=C3C

InChI

InChI=1S/C20H20N2O4S2/c1-3-25-19(24)12-27-20-22-15-9-8-14(10-17(15)28-20)21-18(23)11-26-16-7-5-4-6-13(16)2/h4-10H,3,11-12H2,1-2H3,(H,21,23)