N-(6-bromanyl-1,3-benzothiazol-2-yl)-N-(2-diethylaminoethyl)-2-phenylsulfanyl-ethanamide

Systemtic Name: N-(6-bromanyl-1,3-benzothiazol-2-yl)-N-(2-diethylaminoethyl)-2-phenylsulfanyl-ethanamide Openeye Name: N-(6-bromo-1,3-benzothiazol-2-yl)-N-(2-diethylaminoethyl)-2-phenylsulfanyl-acetamide CAS Name: N-(6-bromo-1,3-benzothiazol-2-yl)-N-(2-diethylaminoethyl)-2-(phenylthio)acetamide IUPAC Name: N-(6-bromo-1,3-benzothiazol-2-yl)-N-(2-diethylaminoethyl)-2-phenylsulfanylacetamide Traditional Name: N-(6-bromo-1,3-benzothiazol-2-yl)-N-(2-diethylaminoethyl)-2-(phenylthio)acetamide Formula: C21H24BrN3OS2 MolecularWeight: 478.46876

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN(C1=NC2=C(S1)C=C(C=C2)Br)C(=O)CSC3=CC=CC=C3

Isomeric SMILES

CCN(CC)CCN(C1=NC2=C(S1)C=C(C=C2)Br)C(=O)CSC3=CC=CC=C3

InChI

InChI=1S/C21H24BrN3OS2/c1-3-24(4-2)12-13-25(20(26)15-27-17-8-6-5-7-9-17)21-23-18-11-10-16(22)14-19(18)28-21/h5-11,14H,3-4,12-13,15H2,1-2H3