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

Systemtic Name: N-(3-methylbutyl)-2-[(4-methylphenyl)methylsulfanylmethyl]-3-oxidanylidene-2,4-dihydro-1H-quinoxaline-6-carboxamide Openeye Name: N-isopentyl-3-oxo-2-(p-tolylmethylsulfanylmethyl)-2,4-dihydro-1H-quinoxaline-6-carboxamide CAS Name: N-(3-methylbutyl)-2-[[(4-methylphenyl)methylthio]methyl]-3-oxo-2,4-dihydro-1H-quinoxaline-6-carboxamide IUPAC Name: N-(3-methylbutyl)-2-[(4-methylphenyl)methylsulfanylmethyl]-3-oxo-2,4-dihydro-1H-quinoxaline-6-carboxamide Traditional Name: N-isoamyl-3-keto-2-[[(4-methylbenzyl)thio]methyl]-2,4-dihydro-1H-quinoxaline-6-carboxamide Formula: C23H29N3O2S MolecularWeight: 411.56026

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSCC2C(=O)NC3=C(N2)C=CC(=C3)C(=O)NCCC(C)C

Isomeric SMILES

CC1=CC=C(C=C1)CSCC2C(=O)NC3=C(N2)C=CC(=C3)C(=O)NCCC(C)C

InChI

InChI=1S/C23H29N3O2S/c1-15(2)10-11-24-22(27)18-8-9-19-20(12-18)26-23(28)21(25-19)14-29-13-17-6-4-16(3)5-7-17/h4-9,12,15,21,25H,10-11,13-14H2,1-3H3,(H,24,27)(H,26,28)