4-azanyl-N5-[2-(tert-butylamino)-2-oxidanylidene-ethyl]-N5-(2-fluorophenyl)-1,2-thiazole-3,5-dicarboxamide

Systemtic Name: 4-azanyl-N5-[2-(tert-butylamino)-2-oxidanylidene-ethyl]-N5-(2-fluorophenyl)-1,2-thiazole-3,5-dicarboxamide Openeye Name: 4-amino-N5-[2-(tert-butylamino)-2-oxo-ethyl]-N5-(2-fluorophenyl)isothiazole-3,5-dicarboxamide CAS Name: 4-amino-N5-[2-(tert-butylamino)-2-oxoethyl]-N5-(2-fluorophenyl)isothiazole-3,5-dicarboxamide IUPAC Name: 4-amino-5-N-[2-(tert-butylamino)-2-oxoethyl]-5-N-(2-fluorophenyl)-1,2-thiazole-3,5-dicarboxamide Traditional Name: 4-amino-N'-[2-(tert-butylamino)-2-keto-ethyl]-N'-(2-fluorophenyl)isothiazole-3,5-dicarboxamide Formula: C17H20FN5O3S MolecularWeight: 393.435803

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)CN(C1=CC=CC=C1F)C(=O)C2=C(C(=NS2)C(=O)N)N

Isomeric SMILES

CC(C)(C)NC(=O)CN(C1=CC=CC=C1F)C(=O)C2=C(C(=NS2)C(=O)N)N

InChI

InChI=1S/C17H20FN5O3S/c1-17(2,3)21-11(24)8-23(10-7-5-4-6-9(10)18)16(26)14-12(19)13(15(20)25)22-27-14/h4-7H,8,19H2,1-3H3,(H2,20,25)(H,21,24)