ethyl 3-cyano-2-(2-ethoxy-2-oxidanylidene-ethyl)sulfanyl-6,8-dimethyl-indolizine-1-carboxylate

Systemtic Name: ethyl 3-cyano-2-(2-ethoxy-2-oxidanylidene-ethyl)sulfanyl-6,8-dimethyl-indolizine-1-carboxylate Openeye Name: ethyl 3-cyano-2-(2-ethoxy-2-oxo-ethyl)sulfanyl-6,8-dimethyl-indolizine-1-carboxylate CAS Name: 3-cyano-2-[(2-ethoxy-2-oxoethyl)thio]-6,8-dimethyl-1-indolizinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-cyano-2-(2-ethoxy-2-oxoethyl)sulfanyl-6,8-dimethylindolizine-1-carboxylate Traditional Name: 3-cyano-2-[(2-ethoxy-2-keto-ethyl)thio]-6,8-dimethyl-indolizine-1-carboxylic acid ethyl ester Formula: C18H20N2O4S MolecularWeight: 360.4274

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=C(N2C=C(C=C(C2=C1C(=O)OCC)C)C)C#N

Isomeric SMILES

CCOC(=O)CSC1=C(N2C=C(C=C(C2=C1C(=O)OCC)C)C)C#N

InChI

InChI=1S/C18H20N2O4S/c1-5-23-14(21)10-25-17-13(8-19)20-9-11(3)7-12(4)16(20)15(17)18(22)24-6-2/h7,9H,5-6,10H2,1-4H3