N-[4-(4-acetamido-2-fluoranyl-phenyl)-1,3-thiazol-2-yl]-1-(4-bromophenyl)cyclopropane-1-carboxamide

Systemtic Name: N-[4-(4-acetamido-2-fluoranyl-phenyl)-1,3-thiazol-2-yl]-1-(4-bromophenyl)cyclopropane-1-carboxamide Openeye Name: N-[4-(4-acetamido-2-fluoro-phenyl)thiazol-2-yl]-1-(4-bromophenyl)cyclopropanecarboxamide CAS Name: N-[4-(4-acetamido-2-fluorophenyl)-2-thiazolyl]-1-(4-bromophenyl)-1-cyclopropanecarboxamide IUPAC Name: N-[4-(4-acetamido-2-fluorophenyl)-1,3-thiazol-2-yl]-1-(4-bromophenyl)cyclopropane-1-carboxamide Traditional Name: N-[4-(4-acetamido-2-fluoro-phenyl)thiazol-2-yl]-1-(4-bromophenyl)cyclopropanecarboxamide Formula: C21H17BrFN3O2S MolecularWeight: 474.345983

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=C(C=C1)C2=CSC(=N2)NC(=O)C3(CC3)C4=CC=C(C=C4)Br)F

Isomeric SMILES

CC(=O)NC1=CC(=C(C=C1)C2=CSC(=N2)NC(=O)C3(CC3)C4=CC=C(C=C4)Br)F

InChI

InChI=1S/C21H17BrFN3O2S/c1-12(27)24-15-6-7-16(17(23)10-15)18-11-29-20(25-18)26-19(28)21(8-9-21)13-2-4-14(22)5-3-13/h2-7,10-11H,8-9H2,1H3,(H,24,27)(H,25,26,28)