N-(2-diethylaminoethyl)-N-(6-fluoranyl-1,3-benzothiazol-2-yl)-4-(phenylcarbonyl)benzamide

Systemtic Name: N-(2-diethylaminoethyl)-N-(6-fluoranyl-1,3-benzothiazol-2-yl)-4-(phenylcarbonyl)benzamide Openeye Name: 4-benzoyl-N-(2-diethylaminoethyl)-N-(6-fluoro-1,3-benzothiazol-2-yl)benzamide CAS Name: 4-benzoyl-N-(2-diethylaminoethyl)-N-(6-fluoro-1,3-benzothiazol-2-yl)benzamide IUPAC Name: 4-benzoyl-N-(2-diethylaminoethyl)-N-(6-fluoro-1,3-benzothiazol-2-yl)benzamide Traditional Name: 4-benzoyl-N-(2-diethylaminoethyl)-N-(6-fluoro-1,3-benzothiazol-2-yl)benzamide Formula: C27H26FN3O2S MolecularWeight: 475.577643

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN(C1=NC2=C(S1)C=C(C=C2)F)C(=O)C3=CC=C(C=C3)C(=O)C4=CC=CC=C4

Isomeric SMILES

CCN(CC)CCN(C1=NC2=C(S1)C=C(C=C2)F)C(=O)C3=CC=C(C=C3)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C27H26FN3O2S/c1-3-30(4-2)16-17-31(27-29-23-15-14-22(28)18-24(23)34-27)26(33)21-12-10-20(11-13-21)25(32)19-8-6-5-7-9-19/h5-15,18H,3-4,16-17H2,1-2H3