propan-2-yl (2S)-7-ethoxy-2-(methylsulfanylmethyl)-3-sulfanylidene-2,4-dihydroquinoxaline-1-carboxylate

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)NC(=S)C(N2C(=O)OC(C)C)CSC

Isomeric SMILES

CCOC1=CC2=C(C=C1)NC(=S)[C@@H](N2C(=O)OC(C)C)CSC

InChI

InChI=1S/C16H22N2O3S2/c1-5-20-11-6-7-12-13(8-11)18(16(19)21-10(2)3)14(9-23-4)15(22)17-12/h6-8,10,14H,5,9H2,1-4H3,(H,17,22)/t14-/m0/s1