N-(1,3-benzothiazol-2-ylmethyl)-2-[(4-fluorophenyl)sulfonyl-methyl-amino]ethanamide

Systemtic Name: N-(1,3-benzothiazol-2-ylmethyl)-2-[(4-fluorophenyl)sulfonyl-methyl-amino]ethanamide Openeye Name: N-(1,3-benzothiazol-2-ylmethyl)-2-[(4-fluorophenyl)sulfonyl-methyl-amino]acetamide CAS Name: N-(1,3-benzothiazol-2-ylmethyl)-2-[(4-fluorophenyl)sulfonyl-methylamino]acetamide IUPAC Name: N-(1,3-benzothiazol-2-ylmethyl)-2-[(4-fluorophenyl)sulfonyl-methylamino]acetamide Traditional Name: N-(1,3-benzothiazol-2-ylmethyl)-2-[(4-fluorophenyl)sulfonyl-methyl-amino]acetamide Formula: C17H16FN3O3S2 MolecularWeight: 393.455643

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NCC1=NC2=CC=CC=C2S1)S(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CN(CC(=O)NCC1=NC2=CC=CC=C2S1)S(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C17H16FN3O3S2/c1-21(26(23,24)13-8-6-12(18)7-9-13)11-16(22)19-10-17-20-14-4-2-3-5-15(14)25-17/h2-9H,10-11H2,1H3,(H,19,22)