phenyl 3-[1-(3-phenethylsulfanyl-2H-pyran-2-yl)-5-phenyl-pyrrol-2-yl]propanoate

Systemtic Name: phenyl 3-[1-(3-phenethylsulfanyl-2H-pyran-2-yl)-5-phenyl-pyrrol-2-yl]propanoate Openeye Name: phenyl 3-[1-(3-phenethylsulfanyl-2H-pyran-2-yl)-5-phenyl-pyrrol-2-yl]propanoate CAS Name: 3-[1-[3-(phenethylthio)-2H-pyran-2-yl]-5-phenyl-2-pyrrolyl]propanoic acid phenyl ester IUPAC Name: phenyl 3-[1-(3-phenethylsulfanyl-2H-pyran-2-yl)-5-phenylpyrrol-2-yl]propanoate Traditional Name: 3-[1-[3-(phenethylthio)-2H-pyran-2-yl]-5-phenyl-pyrrol-2-yl]propionic acid phenyl ester Formula: C32H29NO3S MolecularWeight: 507.64256

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCSC2=CC=COC2N3C(=CC=C3C4=CC=CC=C4)CCC(=O)OC5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)CCSC2=CC=COC2N3C(=CC=C3C4=CC=CC=C4)CCC(=O)OC5=CC=CC=C5

InChI

InChI=1S/C32H29NO3S/c34-31(36-28-15-8-3-9-16-28)21-19-27-18-20-29(26-13-6-2-7-14-26)33(27)32-30(17-10-23-35-32)37-24-22-25-11-4-1-5-12-25/h1-18,20,23,32H,19,21-22,24H2