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

Systemtic Name: N-(6-bromanyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-2-(2-oxidanylidene-2-piperidin-1-yl-ethyl)sulfanyl-ethanamide Openeye Name: N-(6-bromo-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-2-[2-oxo-2-(1-piperidyl)ethyl]sulfanyl-acetamide CAS Name: N-(6-bromo-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-2-[[2-oxo-2-(1-piperidinyl)ethyl]thio]acetamide IUPAC Name: N-(6-bromo-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-2-(2-oxo-2-piperidin-1-ylethyl)sulfanylacetamide Traditional Name: N-(6-bromo-3-propargyl-1,3-benzothiazol-2-ylidene)-2-[(2-keto-2-piperidino-ethyl)thio]acetamide Formula: C19H20BrN3O2S2 MolecularWeight: 466.415

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Descriptors Computed from Structure

Canonical SMILES:

C#CCN1C2=C(C=C(C=C2)Br)SC1=NC(=O)CSCC(=O)N3CCCCC3

Isomeric SMILES

C#CCN1C2=C(C=C(C=C2)Br)SC1=NC(=O)CSCC(=O)N3CCCCC3

InChI

InChI=1S/C19H20BrN3O2S2/c1-2-8-23-15-7-6-14(20)11-16(15)27-19(23)21-17(24)12-26-13-18(25)22-9-4-3-5-10-22/h1,6-7,11H,3-5,8-10,12-13H2