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

Systemtic Name: ethyl 2-[2-[2-(2-oxidanylidene-2-piperidin-1-yl-ethyl)sulfanylethanoylimino]-1,3-benzothiazol-3-yl]ethanoate Openeye Name: ethyl 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 ethyl ester IUPAC Name: ethyl 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 ethyl ester Formula: C20H25N3O4S2 MolecularWeight: 435.5602

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H25N3O4S2/c1-2-27-19(26)12-23-15-8-4-5-9-16(15)29-20(23)21-17(24)13-28-14-18(25)22-10-6-3-7-11-22/h4-5,8-9H,2-3,6-7,10-14H2,1H3