ethyl 7-methyl-2-(naphthalen-1-ylmethylsulfanyl)-1-(phenylcarbonylsulfanyl)indolizine-3-carboxylate

Systemtic Name: ethyl 7-methyl-2-(naphthalen-1-ylmethylsulfanyl)-1-(phenylcarbonylsulfanyl)indolizine-3-carboxylate Openeye Name: ethyl 1-benzoylsulfanyl-7-methyl-2-(1-naphthylmethylsulfanyl)indolizine-3-carboxylate CAS Name: 1-(benzoylthio)-7-methyl-2-(1-naphthalenylmethylthio)-3-indolizinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-benzoylsulfanyl-7-methyl-2-(naphthalen-1-ylmethylsulfanyl)indolizine-3-carboxylate Traditional Name: 1-(benzoylthio)-7-methyl-2-(1-naphthylmethylthio)indolizine-3-carboxylic acid ethyl ester Formula: C30H25NO3S2 MolecularWeight: 511.6544

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C2N1C=CC(=C2)C)SC(=O)C3=CC=CC=C3)SCC4=CC=CC5=CC=CC=C54

Isomeric SMILES

CCOC(=O)C1=C(C(=C2N1C=CC(=C2)C)SC(=O)C3=CC=CC=C3)SCC4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C30H25NO3S2/c1-3-34-29(32)26-28(35-19-23-14-9-13-21-10-7-8-15-24(21)23)27(25-18-20(2)16-17-31(25)26)36-30(33)22-11-5-4-6-12-22/h4-18H,3,19H2,1-2H3