ethyl 1-[[3-ethoxycarbonyl-7-methyl-2-(naphthalen-1-ylmethylsulfanyl)indolizin-1-yl]disulfanyl]-7-methyl-2-(naphthalen-1-ylmethylsulfanyl)indolizine-3-carboxylate

Systemtic Name: ethyl 1-[[3-ethoxycarbonyl-7-methyl-2-(naphthalen-1-ylmethylsulfanyl)indolizin-1-yl]disulfanyl]-7-methyl-2-(naphthalen-1-ylmethylsulfanyl)indolizine-3-carboxylate Openeye Name: ethyl 1-[[3-ethoxycarbonyl-7-methyl-2-(1-naphthylmethylsulfanyl)indolizin-1-yl]disulfanyl]-7-methyl-2-(1-naphthylmethylsulfanyl)indolizine-3-carboxylate CAS Name: 1-[[3-ethoxycarbonyl-7-methyl-2-(1-naphthalenylmethylthio)-1-indolizinyl]disulfanyl]-7-methyl-2-(1-naphthalenylmethylthio)-3-indolizinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[[3-ethoxycarbonyl-7-methyl-2-(naphthalen-1-ylmethylsulfanyl)indolizin-1-yl]disulfanyl]-7-methyl-2-(naphthalen-1-ylmethylsulfanyl)indolizine-3-carboxylate Traditional Name: 1-[[3-carbethoxy-7-methyl-2-(1-naphthylmethylthio)indolizin-1-yl]disulfanyl]-7-methyl-2-(1-naphthylmethylthio)indolizine-3-carboxylic acid ethyl ester Formula: C46H40N2O4S4 MolecularWeight: 813.0808

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C2N1C=CC(=C2)C)SSC3=C4C=C(C=CN4C(=C3SCC5=CC=CC6=CC=CC=C65)C(=O)OCC)C)SCC7=CC=CC8=CC=CC=C87

Isomeric SMILES

CCOC(=O)C1=C(C(=C2N1C=CC(=C2)C)SSC3=C4C=C(C=CN4C(=C3SCC5=CC=CC6=CC=CC=C65)C(=O)OCC)C)SCC7=CC=CC8=CC=CC=C87

InChI

InChI=1S/C46H40N2O4S4/c1-5-51-45(49)39-43(53-27-33-17-11-15-31-13-7-9-19-35(31)33)41(37-25-29(3)21-23-47(37)39)55-56-42-38-26-30(4)22-24-48(38)40(46(50)52-6-2)44(42)54-28-34-18-12-16-32-14-8-10-20-36(32)34/h7-26H,5-6,27-28H2,1-4H3