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

Systemtic Name: 2-[(2-methylphenyl)methylsulfanylmethyl]-3-oxidanylidene-N-propyl-2,4-dihydro-1H-quinoxaline-6-carboxamide Openeye Name: 2-(o-tolylmethylsulfanylmethyl)-3-oxo-N-propyl-2,4-dihydro-1H-quinoxaline-6-carboxamide CAS Name: 2-[[(2-methylphenyl)methylthio]methyl]-3-oxo-N-propyl-2,4-dihydro-1H-quinoxaline-6-carboxamide IUPAC Name: 2-[(2-methylphenyl)methylsulfanylmethyl]-3-oxo-N-propyl-2,4-dihydro-1H-quinoxaline-6-carboxamide Traditional Name: 3-keto-2-[[(2-methylbenzyl)thio]methyl]-N-propyl-2,4-dihydro-1H-quinoxaline-6-carboxamide Formula: C21H25N3O2S MolecularWeight: 383.5071

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1=CC2=C(C=C1)NC(C(=O)N2)CSCC3=CC=CC=C3C

Isomeric SMILES

CCCNC(=O)C1=CC2=C(C=C1)NC(C(=O)N2)CSCC3=CC=CC=C3C

InChI

InChI=1S/C21H25N3O2S/c1-3-10-22-20(25)15-8-9-17-18(11-15)24-21(26)19(23-17)13-27-12-16-7-5-4-6-14(16)2/h4-9,11,19,23H,3,10,12-13H2,1-2H3,(H,22,25)(H,24,26)