2-[(2,5-dimethylphenyl)methylsulfanylmethyl]-3-oxidanylidene-N-propyl-2,4-dihydro-1H-quinoxaline-6-carboxamide

Systemtic Name: 2-[(2,5-dimethylphenyl)methylsulfanylmethyl]-3-oxidanylidene-N-propyl-2,4-dihydro-1H-quinoxaline-6-carboxamide Openeye Name: 2-[(2,5-dimethylphenyl)methylsulfanylmethyl]-3-oxo-N-propyl-2,4-dihydro-1H-quinoxaline-6-carboxamide CAS Name: 2-[[(2,5-dimethylphenyl)methylthio]methyl]-3-oxo-N-propyl-2,4-dihydro-1H-quinoxaline-6-carboxamide IUPAC Name: 2-[(2,5-dimethylphenyl)methylsulfanylmethyl]-3-oxo-N-propyl-2,4-dihydro-1H-quinoxaline-6-carboxamide Traditional Name: 2-[[(2,5-dimethylbenzyl)thio]methyl]-3-keto-N-propyl-2,4-dihydro-1H-quinoxaline-6-carboxamide Formula: C22H27N3O2S MolecularWeight: 397.53368

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27N3O2S/c1-4-9-23-21(26)16-7-8-18-19(11-16)25-22(27)20(24-18)13-28-12-17-10-14(2)5-6-15(17)3/h5-8,10-11,20,24H,4,9,12-13H2,1-3H3,(H,23,26)(H,25,27)