[2-(3-methyl-1-benzothiophen-2-yl)-2-oxidanylidene-ethyl] 2-(1,3-benzothiazol-2-ylmethoxy)ethanoate

Systemtic Name: [2-(3-methyl-1-benzothiophen-2-yl)-2-oxidanylidene-ethyl] 2-(1,3-benzothiazol-2-ylmethoxy)ethanoate Openeye Name: [2-(3-methylbenzothiophen-2-yl)-2-oxo-ethyl] 2-(1,3-benzothiazol-2-ylmethoxy)acetate CAS Name: 2-(1,3-benzothiazol-2-ylmethoxy)acetic acid [2-(3-methyl-1-benzothiophen-2-yl)-2-oxoethyl] ester IUPAC Name: [2-(3-methyl-1-benzothiophen-2-yl)-2-oxoethyl] 2-(1,3-benzothiazol-2-ylmethoxy)acetate Traditional Name: 2-(1,3-benzothiazol-2-ylmethoxy)acetic acid [2-keto-2-(3-methylbenzothiophen-2-yl)ethyl] ester Formula: C21H17NO4S2 MolecularWeight: 411.49398

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=CC=CC=C12)C(=O)COC(=O)COCC3=NC4=CC=CC=C4S3

Isomeric SMILES

CC1=C(SC2=CC=CC=C12)C(=O)COC(=O)COCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H17NO4S2/c1-13-14-6-2-4-8-17(14)28-21(13)16(23)10-26-20(24)12-25-11-19-22-15-7-3-5-9-18(15)27-19/h2-9H,10-12H2,1H3