N-[4-(4-acetamido-2-fluoranyl-phenyl)-1,3-thiazol-2-yl]-5-(1,3-benzothiazol-2-yl)pentanamide

Systemtic Name: N-[4-(4-acetamido-2-fluoranyl-phenyl)-1,3-thiazol-2-yl]-5-(1,3-benzothiazol-2-yl)pentanamide Openeye Name: N-[4-(4-acetamido-2-fluoro-phenyl)thiazol-2-yl]-5-(1,3-benzothiazol-2-yl)pentanamide CAS Name: N-[4-(4-acetamido-2-fluorophenyl)-2-thiazolyl]-5-(1,3-benzothiazol-2-yl)pentanamide IUPAC Name: N-[4-(4-acetamido-2-fluorophenyl)-1,3-thiazol-2-yl]-5-(1,3-benzothiazol-2-yl)pentanamide Traditional Name: N-[4-(4-acetamido-2-fluoro-phenyl)thiazol-2-yl]-5-(1,3-benzothiazol-2-yl)valeramide Formula: C23H21FN4O2S2 MolecularWeight: 468.566843

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=C(C=C1)C2=CSC(=N2)NC(=O)CCCCC3=NC4=CC=CC=C4S3)F

Isomeric SMILES

CC(=O)NC1=CC(=C(C=C1)C2=CSC(=N2)NC(=O)CCCCC3=NC4=CC=CC=C4S3)F

InChI

InChI=1S/C23H21FN4O2S2/c1-14(29)25-15-10-11-16(17(24)12-15)19-13-31-23(27-19)28-21(30)8-4-5-9-22-26-18-6-2-3-7-20(18)32-22/h2-3,6-7,10-13H,4-5,8-9H2,1H3,(H,25,29)(H,27,28,30)