N-butyl-2-[(4-fluorophenyl)methylsulfanylmethyl]-N-methyl-3-oxidanylidene-2,4-dihydro-1H-quinoxaline-6-carboxamide

Systemtic Name: N-butyl-2-[(4-fluorophenyl)methylsulfanylmethyl]-N-methyl-3-oxidanylidene-2,4-dihydro-1H-quinoxaline-6-carboxamide Openeye Name: N-butyl-2-[(4-fluorophenyl)methylsulfanylmethyl]-N-methyl-3-oxo-2,4-dihydro-1H-quinoxaline-6-carboxamide CAS Name: N-butyl-2-[[(4-fluorophenyl)methylthio]methyl]-N-methyl-3-oxo-2,4-dihydro-1H-quinoxaline-6-carboxamide IUPAC Name: N-butyl-2-[(4-fluorophenyl)methylsulfanylmethyl]-N-methyl-3-oxo-2,4-dihydro-1H-quinoxaline-6-carboxamide Traditional Name: N-butyl-2-[[(4-fluorobenzyl)thio]methyl]-3-keto-N-methyl-2,4-dihydro-1H-quinoxaline-6-carboxamide Formula: C22H26FN3O2S MolecularWeight: 415.524143

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C)C(=O)C1=CC2=C(C=C1)NC(C(=O)N2)CSCC3=CC=C(C=C3)F

Isomeric SMILES

CCCCN(C)C(=O)C1=CC2=C(C=C1)NC(C(=O)N2)CSCC3=CC=C(C=C3)F

InChI

InChI=1S/C22H26FN3O2S/c1-3-4-11-26(2)22(28)16-7-10-18-19(12-16)25-21(27)20(24-18)14-29-13-15-5-8-17(23)9-6-15/h5-10,12,20,24H,3-4,11,13-14H2,1-2H3,(H,25,27)