N-(4-fluorophenyl)-2-(2-methylpropanoylamino)-4-oxidanylidene-thiochromene-3-carboxamide

Systemtic Name: N-(4-fluorophenyl)-2-(2-methylpropanoylamino)-4-oxidanylidene-thiochromene-3-carboxamide Openeye Name: N-(4-fluorophenyl)-2-(2-methylpropanoylamino)-4-oxo-thiochromene-3-carboxamide CAS Name: N-(4-fluorophenyl)-2-[(2-methyl-1-oxopropyl)amino]-4-oxo-1-benzothiopyran-3-carboxamide IUPAC Name: N-(4-fluorophenyl)-2-(2-methylpropanoylamino)-4-oxothiochromene-3-carboxamide Traditional Name: N-(4-fluorophenyl)-2-(isobutyrylamino)-4-keto-thiochromene-3-carboxamide Formula: C20H17FN2O3S MolecularWeight: 384.423983

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=C(C(=O)C2=CC=CC=C2S1)C(=O)NC3=CC=C(C=C3)F

Isomeric SMILES

CC(C)C(=O)NC1=C(C(=O)C2=CC=CC=C2S1)C(=O)NC3=CC=C(C=C3)F

InChI

InChI=1S/C20H17FN2O3S/c1-11(2)18(25)23-20-16(17(24)14-5-3-4-6-15(14)27-20)19(26)22-13-9-7-12(21)8-10-13/h3-11H,1-2H3,(H,22,26)(H,23,25)