ethyl 6-methyl-1-[(2-methylnaphthalen-1-yl)methylsulfanyl]-3-(phenylcarbonyl)thieno[3,4-b]indolizine-4-carboxylate

Systemtic Name: ethyl 6-methyl-1-[(2-methylnaphthalen-1-yl)methylsulfanyl]-3-(phenylcarbonyl)thieno[3,4-b]indolizine-4-carboxylate Openeye Name: ethyl 3-benzoyl-6-methyl-1-[(2-methyl-1-naphthyl)methylsulfanyl]thieno[3,4-b]indolizine-4-carboxylate CAS Name: 3-benzoyl-6-methyl-1-[(2-methyl-1-naphthalenyl)methylthio]-4-thieno[3,4-b]indolizinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-benzoyl-6-methyl-1-[(2-methylnaphthalen-1-yl)methylsulfanyl]thieno[3,4-b]indolizine-4-carboxylate Traditional Name: 3-benzoyl-6-methyl-1-[(2-methyl-1-naphthyl)methylthio]thien[3,4-b]indolizine-4-carboxylic acid ethyl ester Formula: C33H27NO3S2 MolecularWeight: 549.70238

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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=C(C=CC6=CC=CC=C65)C)C

Isomeric SMILES

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

InChI

InChI=1S/C33H27NO3S2/c1-4-37-32(36)27-26-18-20(2)16-17-34(26)29-28(27)31(30(35)23-11-6-5-7-12-23)39-33(29)38-19-25-21(3)14-15-22-10-8-9-13-24(22)25/h5-18H,4,19H2,1-3H3