ethyl 6-methyl-1-methylsulfanyl-3-(phenylcarbonyl)thieno[3,4-b]indolizine-4-carboxylate

Systemtic Name: ethyl 6-methyl-1-methylsulfanyl-3-(phenylcarbonyl)thieno[3,4-b]indolizine-4-carboxylate Openeye Name: ethyl 3-benzoyl-6-methyl-1-methylsulfanyl-thieno[3,4-b]indolizine-4-carboxylate CAS Name: 3-benzoyl-6-methyl-1-(methylthio)-4-thieno[3,4-b]indolizinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-benzoyl-6-methyl-1-methylsulfanylthieno[3,4-b]indolizine-4-carboxylate Traditional Name: 3-benzoyl-6-methyl-1-(methylthio)thien[3,4-b]indolizine-4-carboxylic acid ethyl ester Formula: C22H19NO3S2 MolecularWeight: 409.52116

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2C=C(C=CN2C3=C(SC(=C13)C(=O)C4=CC=CC=C4)SC)C

Isomeric SMILES

CCOC(=O)C1=C2C=C(C=CN2C3=C(SC(=C13)C(=O)C4=CC=CC=C4)SC)C

InChI

InChI=1S/C22H19NO3S2/c1-4-26-21(25)16-15-12-13(2)10-11-23(15)18-17(16)20(28-22(18)27-3)19(24)14-8-6-5-7-9-14/h5-12H,4H2,1-3H3