methyl 2-[2-[2-(2-oxidanylidene-2-piperidin-1-yl-ethyl)sulfanylethanoylimino]-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: methyl 2-[2-[2-(2-oxidanylidene-2-piperidin-1-yl-ethyl)sulfanylethanoylimino]-1,3-benzothiazol-3-yl]ethanoate Openeye Name: methyl 2-[2-[2-[2-oxo-2-(1-piperidyl)ethyl]sulfanylacetyl]imino-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[2-[1-oxo-2-[[2-oxo-2-(1-piperidinyl)ethyl]thio]ethyl]imino-1,3-benzothiazol-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-[2-[2-(2-oxo-2-piperidin-1-ylethyl)sulfanylacetyl]imino-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[2-[2-[(2-keto-2-piperidino-ethyl)thio]acetyl]imino-1,3-benzothiazol-3-yl]acetic acid methyl ester Formula: C19H23N3O4S2 MolecularWeight: 421.53362

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN1C2=CC=CC=C2SC1=NC(=O)CSCC(=O)N3CCCCC3

Isomeric SMILES

COC(=O)CN1C2=CC=CC=C2SC1=NC(=O)CSCC(=O)N3CCCCC3

InChI

InChI=1S/C19H23N3O4S2/c1-26-18(25)11-22-14-7-3-4-8-15(14)28-19(22)20-16(23)12-27-13-17(24)21-9-5-2-6-10-21/h3-4,7-8H,2,5-6,9-13H2,1H3