diethyl 2-(2,3-dihydroindol-1-ylcarbothioylsulfanyl)propanedioate

Systemtic Name: diethyl 2-(2,3-dihydroindol-1-ylcarbothioylsulfanyl)propanedioate Openeye Name: diethyl 2-(indoline-1-carbothioylsulfanyl)propanedioate CAS Name: 2-[[2,3-dihydroindol-1-yl(sulfanylidene)methyl]thio]propanedioic acid diethyl ester IUPAC Name: diethyl 2-(2,3-dihydroindole-1-carbothioylsulfanyl)propanedioate Traditional Name: 2-(indoline-1-carbothioylthio)malonic acid diethyl ester Formula: C16H19NO4S2 MolecularWeight: 353.45636

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(=O)OCC)SC(=S)N1CCC2=CC=CC=C21

Isomeric SMILES

CCOC(=O)C(C(=O)OCC)SC(=S)N1CCC2=CC=CC=C21

InChI

InChI=1S/C16H19NO4S2/c1-3-20-14(18)13(15(19)21-4-2)23-16(22)17-10-9-11-7-5-6-8-12(11)17/h5-8,13H,3-4,9-10H2,1-2H3