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

Systemtic Name: N-[(2S)-4-methylsulfanyl-1-oxidanylidene-1-phenylazanyl-butan-2-yl]-3-oxidanylidene-2,4-dihydroquinoxaline-1-carboxamide Openeye Name: N-[(1S)-3-methylsulfanyl-1-(phenylcarbamoyl)propyl]-3-oxo-2,4-dihydroquinoxaline-1-carboxamide CAS Name: N-[(2S)-1-anilino-4-(methylthio)-1-oxobutan-2-yl]-3-oxo-2,4-dihydroquinoxaline-1-carboxamide IUPAC Name: N-[(2S)-1-anilino-4-methylsulfanyl-1-oxobutan-2-yl]-3-oxo-2,4-dihydroquinoxaline-1-carboxamide Traditional Name: 3-keto-N-[(1S)-3-(methylthio)-1-(phenylcarbamoyl)propyl]-2,4-dihydroquinoxaline-1-carboxamide Formula: C20H22N4O3S MolecularWeight: 398.47868

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)NC1=CC=CC=C1)NC(=O)N2CC(=O)NC3=CC=CC=C32

Isomeric SMILES

CSCC[C@@H](C(=O)NC1=CC=CC=C1)NC(=O)N2CC(=O)NC3=CC=CC=C32

InChI

InChI=1S/C20H22N4O3S/c1-28-12-11-16(19(26)21-14-7-3-2-4-8-14)23-20(27)24-13-18(25)22-15-9-5-6-10-17(15)24/h2-10,16H,11-13H2,1H3,(H,21,26)(H,22,25)(H,23,27)/t16-/m0/s1