N-(6-bromanyl-3-ethyl-1,3-benzothiazol-2-ylidene)-2-[2-(3,5-dimethylpiperidin-1-yl)-2-oxidanylidene-ethyl]sulfanyl-ethanamide

Systemtic Name: N-(6-bromanyl-3-ethyl-1,3-benzothiazol-2-ylidene)-2-[2-(3,5-dimethylpiperidin-1-yl)-2-oxidanylidene-ethyl]sulfanyl-ethanamide Openeye Name: N-(6-bromo-3-ethyl-1,3-benzothiazol-2-ylidene)-2-[2-(3,5-dimethyl-1-piperidyl)-2-oxo-ethyl]sulfanyl-acetamide CAS Name: N-(6-bromo-3-ethyl-1,3-benzothiazol-2-ylidene)-2-[[2-(3,5-dimethyl-1-piperidinyl)-2-oxoethyl]thio]acetamide IUPAC Name: N-(6-bromo-3-ethyl-1,3-benzothiazol-2-ylidene)-2-[2-(3,5-dimethylpiperidin-1-yl)-2-oxoethyl]sulfanylacetamide Traditional Name: N-(6-bromo-3-ethyl-1,3-benzothiazol-2-ylidene)-2-[[2-(3,5-dimethylpiperidino)-2-keto-ethyl]thio]acetamide Formula: C20H26BrN3O2S2 MolecularWeight: 484.47334

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)Br)SC1=NC(=O)CSCC(=O)N3CC(CC(C3)C)C

Isomeric SMILES

CCN1C2=C(C=C(C=C2)Br)SC1=NC(=O)CSCC(=O)N3CC(CC(C3)C)C

InChI

InChI=1S/C20H26BrN3O2S2/c1-4-24-16-6-5-15(21)8-17(16)28-20(24)22-18(25)11-27-12-19(26)23-9-13(2)7-14(3)10-23/h5-6,8,13-14H,4,7,9-12H2,1-3H3