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

Systemtic Name: N-[6-bromanyl-3-(2-ethoxyethyl)-1,3-benzothiazol-2-ylidene]-2-[2-(2-ethylpiperidin-1-yl)-2-oxidanylidene-ethyl]sulfanyl-ethanamide Openeye Name: N-[6-bromo-3-(2-ethoxyethyl)-1,3-benzothiazol-2-ylidene]-2-[2-(2-ethyl-1-piperidyl)-2-oxo-ethyl]sulfanyl-acetamide CAS Name: N-[6-bromo-3-(2-ethoxyethyl)-1,3-benzothiazol-2-ylidene]-2-[[2-(2-ethyl-1-piperidinyl)-2-oxoethyl]thio]acetamide IUPAC Name: N-[6-bromo-3-(2-ethoxyethyl)-1,3-benzothiazol-2-ylidene]-2-[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]sulfanylacetamide Traditional Name: N-[6-bromo-3-(2-ethoxyethyl)-1,3-benzothiazol-2-ylidene]-2-[[2-(2-ethylpiperidino)-2-keto-ethyl]thio]acetamide Formula: C22H30BrN3O3S2 MolecularWeight: 528.5259

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1C(=O)CSCC(=O)N=C2N(C3=C(S2)C=C(C=C3)Br)CCOCC

Isomeric SMILES

CCC1CCCCN1C(=O)CSCC(=O)N=C2N(C3=C(S2)C=C(C=C3)Br)CCOCC

InChI

InChI=1S/C22H30BrN3O3S2/c1-3-17-7-5-6-10-25(17)21(28)15-30-14-20(27)24-22-26(11-12-29-4-2)18-9-8-16(23)13-19(18)31-22/h8-9,13,17H,3-7,10-12,14-15H2,1-2H3