N-[3-(2-fluorophenyl)-4-oxidanylidene-thiochromen-2-yl]-3-nitro-benzamide

Systemtic Name: N-[3-(2-fluorophenyl)-4-oxidanylidene-thiochromen-2-yl]-3-nitro-benzamide Openeye Name: N-[3-(2-fluorophenyl)-4-oxo-thiochromen-2-yl]-3-nitro-benzamide CAS Name: N-[3-(2-fluorophenyl)-4-oxo-1-benzothiopyran-2-yl]-3-nitrobenzamide IUPAC Name: N-[3-(2-fluorophenyl)-4-oxothiochromen-2-yl]-3-nitrobenzamide Traditional Name: N-[3-(2-fluorophenyl)-4-keto-thiochromen-2-yl]-3-nitro-benzamide Formula: C22H13FN2O4S MolecularWeight: 420.413023

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=C(SC3=CC=CC=C3C2=O)NC(=O)C4=CC(=CC=C4)[N+](=O)[O-])F

Isomeric SMILES

C1=CC=C(C(=C1)C2=C(SC3=CC=CC=C3C2=O)NC(=O)C4=CC(=CC=C4)[N+](=O)[O-])F

InChI

InChI=1S/C22H13FN2O4S/c23-17-10-3-1-8-15(17)19-20(26)16-9-2-4-11-18(16)30-22(19)24-21(27)13-6-5-7-14(12-13)25(28)29/h1-12H,(H,24,27)