ethyl 1-ethylsulfanyl-5,7-dimethyl-3-(phenylcarbonyl)thieno[3,4-b]indolizine-4-carboxylate

Systemtic Name: ethyl 1-ethylsulfanyl-5,7-dimethyl-3-(phenylcarbonyl)thieno[3,4-b]indolizine-4-carboxylate Openeye Name: ethyl 3-benzoyl-1-ethylsulfanyl-5,7-dimethyl-thieno[3,4-b]indolizine-4-carboxylate CAS Name: 3-benzoyl-1-(ethylthio)-5,7-dimethyl-4-thieno[3,4-b]indolizinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-benzoyl-1-ethylsulfanyl-5,7-dimethylthieno[3,4-b]indolizine-4-carboxylate Traditional Name: 3-benzoyl-1-(ethylthio)-5,7-dimethyl-thien[3,4-b]indolizine-4-carboxylic acid ethyl ester Formula: C24H23NO3S2 MolecularWeight: 437.57432

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H23NO3S2/c1-5-28-23(27)18-17-20(25-13-14(3)12-15(4)19(18)25)24(29-6-2)30-22(17)21(26)16-10-8-7-9-11-16/h7-13H,5-6H2,1-4H3