ethyl 4-[2-(10-propan-2-ylsulfanyldecanoylamino)phenyl]sulfanylbutanoate

Systemtic Name: ethyl 4-[2-(10-propan-2-ylsulfanyldecanoylamino)phenyl]sulfanylbutanoate Openeye Name: ethyl 4-[2-(10-isopropylsulfanyldecanoylamino)phenyl]sulfanylbutanoate CAS Name: 4-[[2-[[1-oxo-10-(propan-2-ylthio)decyl]amino]phenyl]thio]butanoic acid ethyl ester IUPAC Name: ethyl 4-[2-(10-propan-2-ylsulfanyldecanoylamino)phenyl]sulfanylbutanoate Traditional Name: 4-[[2-[10-(isopropylthio)decanoylamino]phenyl]thio]butyric acid ethyl ester Formula: C25H41NO3S2 MolecularWeight: 467.72794

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCSC1=CC=CC=C1NC(=O)CCCCCCCCCSC(C)C

Isomeric SMILES

CCOC(=O)CCCSC1=CC=CC=C1NC(=O)CCCCCCCCCSC(C)C

InChI

InChI=1S/C25H41NO3S2/c1-4-29-25(28)18-14-20-31-23-16-12-11-15-22(23)26-24(27)17-10-8-6-5-7-9-13-19-30-21(2)3/h11-12,15-16,21H,4-10,13-14,17-20H2,1-3H3,(H,26,27)