S-[1-(2-pentanoylsulfanylnaphthalen-1-yl)naphthalen-2-yl] pentanethioate

Systemtic Name: S-[1-(2-pentanoylsulfanylnaphthalen-1-yl)naphthalen-2-yl] pentanethioate Openeye Name: S-[1-(2-pentanoylsulfanyl-1-naphthyl)-2-naphthyl] pentanethioate CAS Name: pentanethioic acid S-[1-[2-(1-oxopentylthio)-1-naphthalenyl]-2-naphthalenyl] ester IUPAC Name: S-[1-(2-pentanoylsulfanylnaphthalen-1-yl)naphthalen-2-yl] pentanethioate Traditional Name: pentanethioic acid S-[1-[2-(valerylthio)-1-naphthyl]-2-naphthyl] ester Formula: C30H30O2S2 MolecularWeight: 486.688

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)SC1=C(C2=CC=CC=C2C=C1)C3=C(C=CC4=CC=CC=C43)SC(=O)CCCC

Isomeric SMILES

CCCCC(=O)SC1=C(C2=CC=CC=C2C=C1)C3=C(C=CC4=CC=CC=C43)SC(=O)CCCC

InChI

InChI=1S/C30H30O2S2/c1-3-5-15-27(31)33-25-19-17-21-11-7-9-13-23(21)29(25)30-24-14-10-8-12-22(24)18-20-26(30)34-28(32)16-6-4-2/h7-14,17-20H,3-6,15-16H2,1-2H3