N-[(2S)-1-(3-methylbutylamino)-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-3-oxidanylidene-2,4-dihydroquinoxaline-1-carboxamide

Systemtic Name: N-[(2S)-1-(3-methylbutylamino)-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-3-oxidanylidene-2,4-dihydroquinoxaline-1-carboxamide Openeye Name: N-[(1S)-1-(isopentylcarbamoyl)-3-methylsulfanyl-propyl]-3-oxo-2,4-dihydroquinoxaline-1-carboxamide CAS Name: N-[(2S)-1-(3-methylbutylamino)-4-(methylthio)-1-oxobutan-2-yl]-3-oxo-2,4-dihydroquinoxaline-1-carboxamide IUPAC Name: N-[(2S)-1-(3-methylbutylamino)-4-methylsulfanyl-1-oxobutan-2-yl]-3-oxo-2,4-dihydroquinoxaline-1-carboxamide Traditional Name: N-[(1S)-1-(isoamylcarbamoyl)-3-(methylthio)propyl]-3-keto-2,4-dihydroquinoxaline-1-carboxamide Formula: C19H28N4O3S MolecularWeight: 392.51562

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)C(CCSC)NC(=O)N1CC(=O)NC2=CC=CC=C21

Isomeric SMILES

CC(C)CCNC(=O)[C@H](CCSC)NC(=O)N1CC(=O)NC2=CC=CC=C21

InChI

InChI=1S/C19H28N4O3S/c1-13(2)8-10-20-18(25)15(9-11-27-3)22-19(26)23-12-17(24)21-14-6-4-5-7-16(14)23/h4-7,13,15H,8-12H2,1-3H3,(H,20,25)(H,21,24)(H,22,26)/t15-/m0/s1