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

Systemtic Name: N-[6-bromanyl-3-(2-methoxyethyl)-1,3-benzothiazol-2-ylidene]-2-[2-(3-methylpiperidin-1-yl)-2-oxidanylidene-ethyl]sulfonyl-ethanamide Openeye Name: N-[6-bromo-3-(2-methoxyethyl)-1,3-benzothiazol-2-ylidene]-2-[2-(3-methyl-1-piperidyl)-2-oxo-ethyl]sulfonyl-acetamide CAS Name: N-[6-bromo-3-(2-methoxyethyl)-1,3-benzothiazol-2-ylidene]-2-[2-(3-methyl-1-piperidinyl)-2-oxoethyl]sulfonylacetamide IUPAC Name: N-[6-bromo-3-(2-methoxyethyl)-1,3-benzothiazol-2-ylidene]-2-[2-(3-methylpiperidin-1-yl)-2-oxoethyl]sulfonylacetamide Traditional Name: N-[6-bromo-3-(2-methoxyethyl)-1,3-benzothiazol-2-ylidene]-2-[2-keto-2-(3-methylpiperidino)ethyl]sulfonyl-acetamide Formula: C20H26BrN3O5S2 MolecularWeight: 532.47154

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C(=O)CS(=O)(=O)CC(=O)N=C2N(C3=C(S2)C=C(C=C3)Br)CCOC

Isomeric SMILES

CC1CCCN(C1)C(=O)CS(=O)(=O)CC(=O)N=C2N(C3=C(S2)C=C(C=C3)Br)CCOC

InChI

InChI=1S/C20H26BrN3O5S2/c1-14-4-3-7-23(11-14)19(26)13-31(27,28)12-18(25)22-20-24(8-9-29-2)16-6-5-15(21)10-17(16)30-20/h5-6,10,14H,3-4,7-9,11-13H2,1-2H3