[2-(cyclooctylamino)-2-oxidanylidene-ethyl] 2-phenyl-2-phenylsulfanyl-ethanoate

Systemtic Name: [2-(cyclooctylamino)-2-oxidanylidene-ethyl] 2-phenyl-2-phenylsulfanyl-ethanoate Openeye Name: [2-(cyclooctylamino)-2-oxo-ethyl] 2-phenyl-2-phenylsulfanyl-acetate CAS Name: 2-phenyl-2-(phenylthio)acetic acid [2-(cyclooctylamino)-2-oxoethyl] ester IUPAC Name: [2-(cyclooctylamino)-2-oxoethyl] 2-phenyl-2-phenylsulfanylacetate Traditional Name: 2-phenyl-2-(phenylthio)acetic acid [2-(cyclooctylamino)-2-keto-ethyl] ester Formula: C24H29NO3S MolecularWeight: 411.55696

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CCC1)NC(=O)COC(=O)C(C2=CC=CC=C2)SC3=CC=CC=C3

Isomeric SMILES

C1CCCC(CCC1)NC(=O)COC(=O)C(C2=CC=CC=C2)SC3=CC=CC=C3

InChI

InChI=1S/C24H29NO3S/c26-22(25-20-14-8-2-1-3-9-15-20)18-28-24(27)23(19-12-6-4-7-13-19)29-21-16-10-5-11-17-21/h4-7,10-13,16-17,20,23H,1-3,8-9,14-15,18H2,(H,25,26)