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

Systemtic Name: N-[(2S)-4-methylsulfanyl-1-oxidanylidene-1-[(phenylmethyl)amino]butan-2-yl]-3-oxidanylidene-2,4-dihydroquinoxaline-1-carboxamide Openeye Name: N-[(1S)-1-(benzylcarbamoyl)-3-methylsulfanyl-propyl]-3-oxo-2,4-dihydroquinoxaline-1-carboxamide CAS Name: N-[(2S)-4-(methylthio)-1-oxo-1-[(phenylmethyl)amino]butan-2-yl]-3-oxo-2,4-dihydroquinoxaline-1-carboxamide IUPAC Name: N-[(2S)-1-(benzylamino)-4-methylsulfanyl-1-oxobutan-2-yl]-3-oxo-2,4-dihydroquinoxaline-1-carboxamide Traditional Name: N-[(1S)-1-(benzylcarbamoyl)-3-(methylthio)propyl]-3-keto-2,4-dihydroquinoxaline-1-carboxamide Formula: C21H24N4O3S MolecularWeight: 412.50526

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)NCC1=CC=CC=C1)NC(=O)N2CC(=O)NC3=CC=CC=C32

Isomeric SMILES

CSCC[C@@H](C(=O)NCC1=CC=CC=C1)NC(=O)N2CC(=O)NC3=CC=CC=C32

InChI

InChI=1S/C21H24N4O3S/c1-29-12-11-17(20(27)22-13-15-7-3-2-4-8-15)24-21(28)25-14-19(26)23-16-9-5-6-10-18(16)25/h2-10,17H,11-14H2,1H3,(H,22,27)(H,23,26)(H,24,28)/t17-/m0/s1