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

Systemtic Name: ethyl 2-(naphthalen-1-ylmethylsulfanyl)-1-(phenylcarbonylsulfanyl)indolizine-3-carboxylate Openeye Name: ethyl 1-benzoylsulfanyl-2-(1-naphthylmethylsulfanyl)indolizine-3-carboxylate CAS Name: 1-(benzoylthio)-2-(1-naphthalenylmethylthio)-3-indolizinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-benzoylsulfanyl-2-(naphthalen-1-ylmethylsulfanyl)indolizine-3-carboxylate Traditional Name: 1-(benzoylthio)-2-(1-naphthylmethylthio)indolizine-3-carboxylic acid ethyl ester Formula: C29H23NO3S2 MolecularWeight: 497.62782

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H23NO3S2/c1-2-33-28(31)25-27(34-19-22-15-10-14-20-11-6-7-16-23(20)22)26(24-17-8-9-18-30(24)25)35-29(32)21-12-4-3-5-13-21/h3-18H,2,19H2,1H3