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

Systemtic Name: butan-2-yl (2S)-7-methoxy-2-(methylsulfanylmethyl)-3-sulfanylidene-2,4-dihydroquinoxaline-1-carboxylate Openeye Name: sec-butyl (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 butan-2-yl ester IUPAC Name: butan-2-yl (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 sec-butyl ester Formula: C16H22N2O3S2 MolecularWeight: 354.48748

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H22N2O3S2/c1-5-10(2)21-16(19)18-13-8-11(20-3)6-7-12(13)17-15(22)14(18)9-23-4/h6-8,10,14H,5,9H2,1-4H3,(H,17,22)/t10?,14-/m0/s1