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

Systemtic Name: ethyl 6-methyl-1-phenacylsulfanyl-3-(phenylcarbonyl)thieno[3,4-b]indolizine-4-carboxylate Openeye Name: ethyl 3-benzoyl-6-methyl-1-phenacylsulfanyl-thieno[3,4-b]indolizine-4-carboxylate CAS Name: 3-benzoyl-6-methyl-1-(phenacylthio)-4-thieno[3,4-b]indolizinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-benzoyl-6-methyl-1-phenacylsulfanylthieno[3,4-b]indolizine-4-carboxylate Traditional Name: 3-benzoyl-6-methyl-1-(phenacylthio)thien[3,4-b]indolizine-4-carboxylic acid ethyl ester Formula: C29H23NO4S2 MolecularWeight: 513.62722

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2C=C(C=CN2C3=C(SC(=C13)C(=O)C4=CC=CC=C4)SCC(=O)C5=CC=CC=C5)C

Isomeric SMILES

CCOC(=O)C1=C2C=C(C=CN2C3=C(SC(=C13)C(=O)C4=CC=CC=C4)SCC(=O)C5=CC=CC=C5)C

InChI

InChI=1S/C29H23NO4S2/c1-3-34-28(33)23-21-16-18(2)14-15-30(21)25-24(23)27(26(32)20-12-8-5-9-13-20)36-29(25)35-17-22(31)19-10-6-4-7-11-19/h4-16H,3,17H2,1-2H3