N-(6-methoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-2-(2-oxidanylidene-2-piperidin-1-yl-ethyl)sulfanyl-ethanamide

Systemtic Name: N-(6-methoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-2-(2-oxidanylidene-2-piperidin-1-yl-ethyl)sulfanyl-ethanamide Openeye Name: N-(6-methoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-2-[2-oxo-2-(1-piperidyl)ethyl]sulfanyl-acetamide CAS Name: N-(6-methoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-2-[[2-oxo-2-(1-piperidinyl)ethyl]thio]acetamide IUPAC Name: N-(6-methoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-2-(2-oxo-2-piperidin-1-ylethyl)sulfanylacetamide Traditional Name: 2-[(2-keto-2-piperidino-ethyl)thio]-N-(6-methoxy-3-propargyl-1,3-benzothiazol-2-ylidene)acetamide Formula: C20H23N3O3S2 MolecularWeight: 417.54492

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N(C(=NC(=O)CSCC(=O)N3CCCCC3)S2)CC#C

Isomeric SMILES

COC1=CC2=C(C=C1)N(C(=NC(=O)CSCC(=O)N3CCCCC3)S2)CC#C

InChI

InChI=1S/C20H23N3O3S2/c1-3-9-23-16-8-7-15(26-2)12-17(16)28-20(23)21-18(24)13-27-14-19(25)22-10-5-4-6-11-22/h1,7-8,12H,4-6,9-11,13-14H2,2H3