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

Systemtic Name: N-[(2S)-1-[(2,4-dimethoxyphenyl)amino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-3-oxidanylidene-2,4-dihydroquinoxaline-1-carboxamide Openeye Name: N-[(1S)-1-[(2,4-dimethoxyphenyl)carbamoyl]-3-methylsulfanyl-propyl]-3-oxo-2,4-dihydroquinoxaline-1-carboxamide CAS Name: N-[(2S)-1-(2,4-dimethoxyanilino)-4-(methylthio)-1-oxobutan-2-yl]-3-oxo-2,4-dihydroquinoxaline-1-carboxamide IUPAC Name: N-[(2S)-1-(2,4-dimethoxyanilino)-4-methylsulfanyl-1-oxobutan-2-yl]-3-oxo-2,4-dihydroquinoxaline-1-carboxamide Traditional Name: N-[(1S)-1-[(2,4-dimethoxyphenyl)carbamoyl]-3-(methylthio)propyl]-3-keto-2,4-dihydroquinoxaline-1-carboxamide Formula: C22H26N4O5S MolecularWeight: 458.53064

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC(=O)C(CCSC)NC(=O)N2CC(=O)NC3=CC=CC=C32)OC

Isomeric SMILES

COC1=CC(=C(C=C1)NC(=O)[C@H](CCSC)NC(=O)N2CC(=O)NC3=CC=CC=C32)OC

InChI

InChI=1S/C22H26N4O5S/c1-30-14-8-9-16(19(12-14)31-2)24-21(28)17(10-11-32-3)25-22(29)26-13-20(27)23-15-6-4-5-7-18(15)26/h4-9,12,17H,10-11,13H2,1-3H3,(H,23,27)(H,24,28)(H,25,29)/t17-/m0/s1