N-(6-bromanyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-2-[2-(4-methylpiperidin-1-yl)-2-oxidanylidene-ethyl]sulfanyl-ethanamide

Systemtic Name: N-(6-bromanyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-2-[2-(4-methylpiperidin-1-yl)-2-oxidanylidene-ethyl]sulfanyl-ethanamide Openeye Name: N-(6-bromo-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-2-[2-(4-methyl-1-piperidyl)-2-oxo-ethyl]sulfanyl-acetamide CAS Name: N-(6-bromo-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-2-[[2-(4-methyl-1-piperidinyl)-2-oxoethyl]thio]acetamide IUPAC Name: N-(6-bromo-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-2-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]sulfanylacetamide Traditional Name: N-(6-bromo-3-propargyl-1,3-benzothiazol-2-ylidene)-2-[[2-keto-2-(4-methylpiperidino)ethyl]thio]acetamide Formula: C20H22BrN3O2S2 MolecularWeight: 480.44158

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=O)CSCC(=O)N=C2N(C3=C(S2)C=C(C=C3)Br)CC#C

Isomeric SMILES

CC1CCN(CC1)C(=O)CSCC(=O)N=C2N(C3=C(S2)C=C(C=C3)Br)CC#C

InChI

InChI=1S/C20H22BrN3O2S2/c1-3-8-24-16-5-4-15(21)11-17(16)28-20(24)22-18(25)12-27-13-19(26)23-9-6-14(2)7-10-23/h1,4-5,11,14H,6-10,12-13H2,2H3