ethyl 6-methyl-1-(naphthalen-2-ylmethylsulfanyl)-3-(phenylcarbonyl)thieno[3,4-b]indolizine-4-carboxylate

Systemtic Name: ethyl 6-methyl-1-(naphthalen-2-ylmethylsulfanyl)-3-(phenylcarbonyl)thieno[3,4-b]indolizine-4-carboxylate Openeye Name: ethyl 3-benzoyl-6-methyl-1-(2-naphthylmethylsulfanyl)thieno[3,4-b]indolizine-4-carboxylate CAS Name: 3-benzoyl-6-methyl-1-(2-naphthalenylmethylthio)-4-thieno[3,4-b]indolizinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-benzoyl-6-methyl-1-(naphthalen-2-ylmethylsulfanyl)thieno[3,4-b]indolizine-4-carboxylate Traditional Name: 3-benzoyl-6-methyl-1-(2-naphthylmethylthio)thien[3,4-b]indolizine-4-carboxylic acid ethyl ester Formula: C32H25NO3S2 MolecularWeight: 535.6758

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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)SCC5=CC6=CC=CC=C6C=C5)C

Isomeric SMILES

CCOC(=O)C1=C2C=C(C=CN2C3=C(SC(=C13)C(=O)C4=CC=CC=C4)SCC5=CC6=CC=CC=C6C=C5)C

InChI

InChI=1S/C32H25NO3S2/c1-3-36-31(35)26-25-17-20(2)15-16-33(25)28-27(26)30(29(34)23-10-5-4-6-11-23)38-32(28)37-19-21-13-14-22-9-7-8-12-24(22)18-21/h4-18H,3,19H2,1-2H3