N-(4-fluorophenyl)-2-[(2-methyl-1,3-benzothiazol-6-yl)sulfonyl-(phenylmethyl)amino]ethanamide

Systemtic Name: N-(4-fluorophenyl)-2-[(2-methyl-1,3-benzothiazol-6-yl)sulfonyl-(phenylmethyl)amino]ethanamide Openeye Name: 2-[benzyl-[(2-methyl-1,3-benzothiazol-6-yl)sulfonyl]amino]-N-(4-fluorophenyl)acetamide CAS Name: N-(4-fluorophenyl)-2-[(2-methyl-1,3-benzothiazol-6-yl)sulfonyl-(phenylmethyl)amino]acetamide IUPAC Name: 2-[benzyl-[(2-methyl-1,3-benzothiazol-6-yl)sulfonyl]amino]-N-(4-fluorophenyl)acetamide Traditional Name: 2-[benzyl-[(2-methyl-1,3-benzothiazol-6-yl)sulfonyl]amino]-N-(4-fluorophenyl)acetamide Formula: C23H20FN3O3S2 MolecularWeight: 469.551603

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(S1)C=C(C=C2)S(=O)(=O)N(CC3=CC=CC=C3)CC(=O)NC4=CC=C(C=C4)F

Isomeric SMILES

CC1=NC2=C(S1)C=C(C=C2)S(=O)(=O)N(CC3=CC=CC=C3)CC(=O)NC4=CC=C(C=C4)F

InChI

InChI=1S/C23H20FN3O3S2/c1-16-25-21-12-11-20(13-22(21)31-16)32(29,30)27(14-17-5-3-2-4-6-17)15-23(28)26-19-9-7-18(24)8-10-19/h2-13H,14-15H2,1H3,(H,26,28)