ethyl 1-[(2-methylnaphthalen-1-yl)methylsulfanyl]-3-(phenylcarbonyl)thieno[3,4-b]indolizine-4-carboxylate

Systemtic Name: ethyl 1-[(2-methylnaphthalen-1-yl)methylsulfanyl]-3-(phenylcarbonyl)thieno[3,4-b]indolizine-4-carboxylate Openeye Name: ethyl 3-benzoyl-1-[(2-methyl-1-naphthyl)methylsulfanyl]thieno[3,4-b]indolizine-4-carboxylate CAS Name: 3-benzoyl-1-[(2-methyl-1-naphthalenyl)methylthio]-4-thieno[3,4-b]indolizinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-benzoyl-1-[(2-methylnaphthalen-1-yl)methylsulfanyl]thieno[3,4-b]indolizine-4-carboxylate Traditional Name: 3-benzoyl-1-[(2-methyl-1-naphthyl)methylthio]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=CC=CN2C3=C(SC(=C13)C(=O)C4=CC=CC=C4)SCC5=C(C=CC6=CC=CC=C65)C

Isomeric SMILES

CCOC(=O)C1=C2C=CC=CN2C3=C(SC(=C13)C(=O)C4=CC=CC=C4)SCC5=C(C=CC6=CC=CC=C65)C

InChI

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