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

Systemtic Name: N-[6-bromanyl-3-(2-methoxyethyl)-1,3-benzothiazol-2-ylidene]-2-[2-(2-ethylpiperidin-1-yl)-2-oxidanylidene-ethyl]sulfanyl-ethanamide Openeye Name: N-[6-bromo-3-(2-methoxyethyl)-1,3-benzothiazol-2-ylidene]-2-[2-(2-ethyl-1-piperidyl)-2-oxo-ethyl]sulfanyl-acetamide CAS Name: N-[6-bromo-3-(2-methoxyethyl)-1,3-benzothiazol-2-ylidene]-2-[[2-(2-ethyl-1-piperidinyl)-2-oxoethyl]thio]acetamide IUPAC Name: N-[6-bromo-3-(2-methoxyethyl)-1,3-benzothiazol-2-ylidene]-2-[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]sulfanylacetamide Traditional Name: N-[6-bromo-3-(2-methoxyethyl)-1,3-benzothiazol-2-ylidene]-2-[[2-(2-ethylpiperidino)-2-keto-ethyl]thio]acetamide Formula: C21H28BrN3O3S2 MolecularWeight: 514.49932

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H28BrN3O3S2/c1-3-16-6-4-5-9-24(16)20(27)14-29-13-19(26)23-21-25(10-11-28-2)17-8-7-15(22)12-18(17)30-21/h7-8,12,16H,3-6,9-11,13-14H2,1-2H3