N-butan-2-yl-2-[(3-fluorophenyl)methylsulfonylmethyl]-3-oxidanylidene-2,4-dihydro-1H-quinoxaline-6-carboxamide

Systemtic Name: N-butan-2-yl-2-[(3-fluorophenyl)methylsulfonylmethyl]-3-oxidanylidene-2,4-dihydro-1H-quinoxaline-6-carboxamide Openeye Name: 2-[(3-fluorophenyl)methylsulfonylmethyl]-3-oxo-N-sec-butyl-2,4-dihydro-1H-quinoxaline-6-carboxamide CAS Name: N-butan-2-yl-2-[(3-fluorophenyl)methylsulfonylmethyl]-3-oxo-2,4-dihydro-1H-quinoxaline-6-carboxamide IUPAC Name: N-butan-2-yl-2-[(3-fluorophenyl)methylsulfonylmethyl]-3-oxo-2,4-dihydro-1H-quinoxaline-6-carboxamide Traditional Name: 2-[(3-fluorobenzyl)sulfonylmethyl]-3-keto-N-sec-butyl-2,4-dihydro-1H-quinoxaline-6-carboxamide Formula: C21H24FN3O4S MolecularWeight: 433.496363

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=CC2=C(C=C1)NC(C(=O)N2)CS(=O)(=O)CC3=CC(=CC=C3)F

Isomeric SMILES

CCC(C)NC(=O)C1=CC2=C(C=C1)NC(C(=O)N2)CS(=O)(=O)CC3=CC(=CC=C3)F

InChI

InChI=1S/C21H24FN3O4S/c1-3-13(2)23-20(26)15-7-8-17-18(10-15)25-21(27)19(24-17)12-30(28,29)11-14-5-4-6-16(22)9-14/h4-10,13,19,24H,3,11-12H2,1-2H3,(H,23,26)(H,25,27)