N-(2-diethylaminoethyl)-2-iodanyl-N-(4-methylsulfanyl-1,3-benzothiazol-2-yl)benzamide

Systemtic Name: N-(2-diethylaminoethyl)-2-iodanyl-N-(4-methylsulfanyl-1,3-benzothiazol-2-yl)benzamide Openeye Name: N-(2-diethylaminoethyl)-2-iodo-N-(4-methylsulfanyl-1,3-benzothiazol-2-yl)benzamide CAS Name: N-(2-diethylaminoethyl)-2-iodo-N-[4-(methylthio)-1,3-benzothiazol-2-yl]benzamide IUPAC Name: N-(2-diethylaminoethyl)-2-iodo-N-(4-methylsulfanyl-1,3-benzothiazol-2-yl)benzamide Traditional Name: N-(2-diethylaminoethyl)-2-iodo-N-[4-(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=CC=C2SC)C(=O)C3=CC=CC=C3I

Isomeric SMILES

CCN(CC)CCN(C1=NC2=C(S1)C=CC=C2SC)C(=O)C3=CC=CC=C3I

InChI

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