3-(4-fluorophenyl)sulfanyl-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)-N-(2-thiophen-2-ylethyl)propanamide

Systemtic Name: 3-(4-fluorophenyl)sulfanyl-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)-N-(2-thiophen-2-ylethyl)propanamide Openeye Name: 3-(4-fluorophenyl)sulfanyl-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)-N-[2-(2-thienyl)ethyl]propanamide CAS Name: 3-[(4-fluorophenyl)thio]-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)-N-(2-thiophen-2-ylethyl)propanamide IUPAC Name: 3-(4-fluorophenyl)sulfanyl-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)-N-(2-thiophen-2-ylethyl)propanamide Traditional Name: 3-[(4-fluorophenyl)thio]-N-(4-mesyl-1,3-benzothiazol-2-yl)-N-[2-(2-thienyl)ethyl]propionamide Formula: C23H21FN2O3S4 MolecularWeight: 520.682843

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC2=C1N=C(S2)N(CCC3=CC=CS3)C(=O)CCSC4=CC=C(C=C4)F

Isomeric SMILES

CS(=O)(=O)C1=CC=CC2=C1N=C(S2)N(CCC3=CC=CS3)C(=O)CCSC4=CC=C(C=C4)F

InChI

InChI=1S/C23H21FN2O3S4/c1-33(28,29)20-6-2-5-19-22(20)25-23(32-19)26(13-11-17-4-3-14-30-17)21(27)12-15-31-18-9-7-16(24)8-10-18/h2-10,14H,11-13,15H2,1H3