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

Systemtic Name: 2-[(4-methylphenyl)methylsulfanylmethyl]-3-oxidanylidene-N-propyl-2,4-dihydro-1H-quinoxaline-6-carboxamide Openeye Name: 3-oxo-N-propyl-2-(p-tolylmethylsulfanylmethyl)-2,4-dihydro-1H-quinoxaline-6-carboxamide CAS Name: 2-[[(4-methylphenyl)methylthio]methyl]-3-oxo-N-propyl-2,4-dihydro-1H-quinoxaline-6-carboxamide IUPAC Name: 2-[(4-methylphenyl)methylsulfanylmethyl]-3-oxo-N-propyl-2,4-dihydro-1H-quinoxaline-6-carboxamide Traditional Name: 3-keto-2-[[(4-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=C(C=C3)C

Isomeric SMILES

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

InChI

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