N-(2-diethylaminoethyl)-2-iodanyl-N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)benzamide

Systemtic Name: N-(2-diethylaminoethyl)-2-iodanyl-N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)benzamide Openeye Name: N-(2-diethylaminoethyl)-2-iodo-N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)benzamide CAS Name: N-(2-diethylaminoethyl)-2-iodo-N-[6-(methylthio)-1,3-benzothiazol-2-yl]benzamide IUPAC Name: N-(2-diethylaminoethyl)-2-iodo-N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)benzamide Traditional Name: N-(2-diethylaminoethyl)-2-iodo-N-[6-(methylthio)-1,3-benzothiazol-2-yl]benzamide Formula: C21H24IN3OS2 MolecularWeight: 525.46923

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN(C1=NC2=C(S1)C=C(C=C2)SC)C(=O)C3=CC=CC=C3I

Isomeric SMILES

CCN(CC)CCN(C1=NC2=C(S1)C=C(C=C2)SC)C(=O)C3=CC=CC=C3I

InChI

InChI=1S/C21H24IN3OS2/c1-4-24(5-2)12-13-25(20(26)16-8-6-7-9-17(16)22)21-23-18-11-10-15(27-3)14-19(18)28-21/h6-11,14H,4-5,12-13H2,1-3H3