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

Systemtic Name: 4-bromanyl-N-(2-diethylaminoethyl)-N-(4-methylsulfanyl-1,3-benzothiazol-2-yl)benzamide Openeye Name: 4-bromo-N-(2-diethylaminoethyl)-N-(4-methylsulfanyl-1,3-benzothiazol-2-yl)benzamide CAS Name: 4-bromo-N-(2-diethylaminoethyl)-N-[4-(methylthio)-1,3-benzothiazol-2-yl]benzamide IUPAC Name: 4-bromo-N-(2-diethylaminoethyl)-N-(4-methylsulfanyl-1,3-benzothiazol-2-yl)benzamide Traditional Name: 4-bromo-N-(2-diethylaminoethyl)-N-[4-(methylthio)-1,3-benzothiazol-2-yl]benzamide Formula: C21H24BrN3OS2 MolecularWeight: 478.46876

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24BrN3OS2/c1-4-24(5-2)13-14-25(20(26)15-9-11-16(22)12-10-15)21-23-19-17(27-3)7-6-8-18(19)28-21/h6-12H,4-5,13-14H2,1-3H3