2-methylpropyl (2S)-7-methoxy-2-(methylsulfanylmethyl)-3-sulfanylidene-2,4-dihydroquinoxaline-1-carboxylate

Systemtic Name: 2-methylpropyl (2S)-7-methoxy-2-(methylsulfanylmethyl)-3-sulfanylidene-2,4-dihydroquinoxaline-1-carboxylate Openeye Name: isobutyl (2S)-7-methoxy-2-(methylsulfanylmethyl)-3-thioxo-2,4-dihydroquinoxaline-1-carboxylate CAS Name: (2S)-7-methoxy-2-[(methylthio)methyl]-3-sulfanylidene-2,4-dihydroquinoxaline-1-carboxylic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl (2S)-7-methoxy-2-(methylsulfanylmethyl)-3-sulfanylidene-2,4-dihydroquinoxaline-1-carboxylate Traditional Name: (2S)-7-methoxy-2-[(methylthio)methyl]-3-thioxo-2,4-dihydroquinoxaline-1-carboxylic acid isobutyl ester Formula: C16H22N2O3S2 MolecularWeight: 354.48748

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)N1C(C(=S)NC2=C1C=C(C=C2)OC)CSC

Isomeric SMILES

CC(C)COC(=O)N1[C@H](C(=S)NC2=C1C=C(C=C2)OC)CSC

InChI

InChI=1S/C16H22N2O3S2/c1-10(2)8-21-16(19)18-13-7-11(20-3)5-6-12(13)17-15(22)14(18)9-23-4/h5-7,10,14H,8-9H2,1-4H3,(H,17,22)/t14-/m0/s1