3-[(1-tert-butylimidazol-2-yl)sulfanylcarbamoylamino]-2-fluoranyl-4-phenyl-benzamide

Systemtic Name: 3-[(1-tert-butylimidazol-2-yl)sulfanylcarbamoylamino]-2-fluoranyl-4-phenyl-benzamide Openeye Name: 3-[(1-tert-butylimidazol-2-yl)sulfanylcarbamoylamino]-2-fluoro-4-phenyl-benzamide CAS Name: 3-[[[[(1-tert-butyl-2-imidazolyl)thio]amino]-oxomethyl]amino]-2-fluoro-4-phenylbenzamide IUPAC Name: 3-[(1-tert-butylimidazol-2-yl)sulfanylcarbamoylamino]-2-fluoro-4-phenylbenzamide Traditional Name: 3-[[(1-tert-butylimidazol-2-yl)thio]carbamoylamino]-2-fluoro-4-phenyl-benzamide Formula: C21H22FN5O2S MolecularWeight: 427.495083

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C=CN=C1SNC(=O)NC2=C(C=CC(=C2F)C(=O)N)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)N1C=CN=C1SNC(=O)NC2=C(C=CC(=C2F)C(=O)N)C3=CC=CC=C3

InChI

InChI=1S/C21H22FN5O2S/c1-21(2,3)27-12-11-24-20(27)30-26-19(29)25-17-14(13-7-5-4-6-8-13)9-10-15(16(17)22)18(23)28/h4-12H,1-3H3,(H2,23,28)(H2,25,26,29)